6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine

C179H201F17N44O8 — CID 159512123

IUPAC6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine
SMILESC=C(C)N1CCC(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc2)CC1(C)C.C=C(C)N1CCC2(CC1)CN(c1ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc1)C2.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)nc2)CC1.CC(=O)N(C)C1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1
InChIInChI=1S/C28H32F2N6O.C28H33F2N5O.C26H29F3N6O2.C25H27F3N6O.C24H26F3N7O.2C24H27F2N7O/c1-20(2)35-13-11-28(12-14-35)18-36(19-28)23-6-3-21(4-7-23)15-32-25-9-10-26(34-33-25)37-17-22-5-8-24(27(29)30)31-16-22;1-19(2)35-14-13-23(15-28(35,3)4)22-8-5-20(6-9-22)16-32-25-11-12-26(34-33-25)36-18-21-7-10-24(27(29)30)31-17-21;1-18(36)34(2)21-11-13-35(14-12-21)22-6-3-19(4-7-22)15-31-24-9-10-25(33-32-24)37-17-20-5-8-23(30-16-20)26(27,28)29;1-18(2)33-11-13-34(14-12-33)21-6-3-19(4-7-21)15-30-23-9-10-24(32-31-23)35-17-20-5-8-22(29-16-20)25(26,27)28;1-17(2)33-9-11-34(12-10-33)22-7-4-18(14-30-22)13-29-21-6-8-23(32-31-21)35-16-19-3-5-20(28-15-19)24(25,26)27;1-17(2)32-9-11-33(12-10-32)20-5-4-19(27-15-20)14-29-22-7-8-23(31-30-22)34-16-18-3-6-21(24(25)26)28-13-18;1-17(2)32-9-11-33(12-10-32)22-7-4-18(14-29-22)13-28-21-6-8-23(31-30-21)34-16-19-3-5-20(24(25)26)27-15-19/h3-10,16,27H,1,11-15,17-19H2,2H3,(H,32,33);5-12,17,23,27H,1,13-16,18H2,2-4H3,(H,32,33);3-10,16,21H,11-15,17H2,1-2H3,(H,31,32);3-10,16H,1,11-15,17H2,2H3,(H,30,31);3-8,14-15H,1,9-13,16H2,2H3,(H,29,31);3-8,13,15,24H,1,9-12,14,16H2,2H3,(H,29,30);3-8,14-15,24H,1,9-13,16H2,2H3,(H,28,30)
InChIKeyMASTWHYBBVDSEU-UHFFFAOYSA-N
MW3419.84 g/mol
LogP33.43
Rot. Bonds60

About 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine

6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine (PubChem CID 159512123) has the molecular formula C179H201F17N44O8 and a molecular weight of 3419.84 g/mol. Its IUPAC name is 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine.

Molecular Properties

Compound Name6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine
PubChem CID159512123
Molecular FormulaC179H201F17N44O8
Molecular Weight3419.84 g/mol
Exact Mass3417.64
IUPAC Name6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine
SMILESC=C(C)N1CCC(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc2)CC1(C)C.C=C(C)N1CCC2(CC1)CN(c1ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc1)C2.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)nc2)CC1.CC(=O)N(C)C1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1
InChIInChI=1S/C28H32F2N6O.C28H33F2N5O.C26H29F3N6O2.C25H27F3N6O.C24H26F3N7O.2C24H27F2N7O/c1-20(2)35-13-11-28(12-14-35)18-36(19-28)23-6-3-21(4-7-23)15-32-25-9-10-26(34-33-25)37-17-22-5-8-24(27(29)30)31-16-22;1-19(2)35-14-13-23(15-28(35,3)4)22-8-5-20(6-9-22)16-32-25-11-12-26(34-33-25)36-18-21-7-10-24(27(29)30)31-17-21;1-18(36)34(2)21-11-13-35(14-12-21)22-6-3-19(4-7-22)15-31-24-9-10-25(33-32-24)37-17-20-5-8-23(30-16-20)26(27,28)29;1-18(2)33-11-13-34(14-12-33)21-6-3-19(4-7-21)15-30-23-9-10-24(32-31-23)35-17-20-5-8-22(29-16-20)25(26,27)28;1-17(2)33-9-11-34(12-10-33)22-7-4-18(14-30-22)13-29-21-6-8-23(32-31-21)35-16-19-3-5-20(28-15-19)24(25,26)27;1-17(2)32-9-11-33(12-10-32)20-5-4-19(27-15-20)14-29-22-7-8-23(31-30-22)34-16-18-3-6-21(24(25)26)28-13-18;1-17(2)32-9-11-33(12-10-32)22-7-4-18(14-29-22)13-28-21-6-8-23(31-30-21)34-16-19-3-5-20(24(25)26)27-15-19/h3-10,16,27H,1,11-15,17-19H2,2H3,(H,32,33);5-12,17,23,27H,1,13-16,18H2,2-4H3,(H,32,33);3-10,16,21H,11-15,17H2,1-2H3,(H,31,32);3-10,16H,1,11-15,17H2,2H3,(H,30,31);3-8,14-15H,1,9-13,16H2,2H3,(H,29,31);3-8,13,15,24H,1,9-12,14,16H2,2H3,(H,29,30);3-8,14-15,24H,1,9-13,16H2,2H3,(H,28,30)
InChIKeyMASTWHYBBVDSEU-UHFFFAOYSA-N
XLogP33.43
TPSA517.37 Ų
H-Bond Donors7
H-Bond Acceptors51
Rotatable Bonds60
Heavy Atoms248
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003419.84
LogP ≤ 533.43
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1051

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-[4-[(1S)-1-[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]ethyl]phenyl]piperazin-1-yl]ethanone
CID 155587423
1-[4-[2-Fluoro-4-[1-[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]cyclopropyl]phenyl]piperazin-1-yl]ethanone
CID 155587426
1-[4-[4-[1-[[6-[[6-(Trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]cyclopropyl]phenyl]piperazin-1-yl]ethanone
CID 155587433
1-[4-[4-[(1R)-1-[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]ethyl]phenyl]piperazin-1-yl]ethanone
CID 155587437
1-[4-[4-[1-[[6-[[6-(Trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]ethyl]phenyl]piperazin-1-yl]ethanone
CID 155587445
US11485727, Example 2.20
CID 155770074
US11485727, Example 2.5
CID 155770078
US11485727, Example 2.17
CID 155770110
US11485727, Example 2.3
CID 155770111
US11485727, Example 2.18
CID 155770114
US11485727, Example 1.6
CID 155770120
US11485727, Example 2.16
CID 155770125

Frequently Asked Questions

What is the IUPAC name of 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine?
The IUPAC name of 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine (CID 159512123) is 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine.
What is the SMILES notation for 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine?
The canonical SMILES for 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine is C=C(C)N1CCC(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc2)CC1(C)C.C=C(C)N1CCC2(CC1)CN(c1ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cc1)C2.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)cn2)CC1.C=C(C)N1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)F)nc4)nn3)nc2)CC1.CC(=O)N(C)C1CCN(c2ccc(CNc3ccc(OCc4ccc(C(F)(F)F)nc4)nn3)cc2)CC1.
What is the InChIKey of 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine?
The InChIKey is MASTWHYBBVDSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32F2N6O.C28H33F2N5O.C26H29F3N6O2.C25H27F3N6O.C24H26F3N7O.2C24H27F2N7O/c1-20(2)35-13-11-28(12-14-35)18-36(19-28)23-6-3-21(4-7-23)15-32-25-9-10-26(34-33-25)37-17-22-5-8-24(27(29)30)31-16-22;1-19(2)35-14-13-23(15-28(35,3)4)22-8-5-20(6-9-22)16-32-25-11-12-26(34-33-25)36-18-21-7-10-24(27(29)30)31-17-21;1-18(36)34(2)21-11-13-35(14-12-21)22-6-3-19(4-7-22)15-31-24-9-10-25(33-32-24)37-17-20-5-8-23(30-16-20)26(27,28)29;1-18(2)33-11-13-34(14-12-33)21-6-3-19(4-7-21)15-30-23-9-10-24(32-31-23)35-17-20-5-8-22(29-16-20)25(26,27)28;1-17(2)33-9-11-34(12-10-33)22-7-4-18(14-30-22)13-29-21-6-8-23(32-31-21)35-16-19-3-5-20(28-15-19)24(25,26)27;1-17(2)32-9-11-33(12-10-32)20-5-4-19(27-15-20)14-29-22-7-8-23(31-30-22)34-16-18-3-6-21(24(25)26)28-13-18;1-17(2)32-9-11-33(12-10-32)22-7-4-18(14-29-22)13-28-21-6-8-23(31-30-21)34-16-19-3-5-20(24(25)26)27-15-19/h3-10,16,27H,1,11-15,17-19H2,2H3,(H,32,33);5-12,17,23,27H,1,13-16,18H2,2-4H3,(H,32,33);3-10,16,21H,11-15,17H2,1-2H3,(H,31,32);3-10,16H,1,11-15,17H2,2H3,(H,30,31);3-8,14-15H,1,9-13,16H2,2H3,(H,29,31);3-8,13,15,24H,1,9-12,14,16H2,2H3,(H,29,30);3-8,14-15,24H,1,9-13,16H2,2H3,(H,28,30).
What are the key properties of 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine?
6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine has a molecular weight of 3419.84 g/mol, XLogP of 33.43, 60 rotatable bonds, 7 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(2,2-dimethyl-1-prop-1-en-2-ylpiperidin-4-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[4-(7-prop-1-en-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phenyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[5-(4-prop-1-en-2-ylpiperazin-1-yl)-2-pyridinyl]methyl]pyridazin-3-amine;6-[[6-(difluoromethyl)-3-pyridinyl]methoxy]-N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]pyridazin-3-amine;N-methyl-N-[1-[4-[[[6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-yl]amino]methyl]phenyl]piperidin-4-yl]acetamide;N-[[4-(4-prop-1-en-2-ylpiperazin-1-yl)phenyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine;N-[[6-(4-prop-1-en-2-ylpiperazin-1-yl)-3-pyridinyl]methyl]-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]pyridazin-3-amine is sourced from PubChem (CID 159512123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).