2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride

C122H129Cl3F8N34O15 — CID 158154989

IUPAC2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride
SMILESCCN1CCN(C(=O)Nc2cc(-c3cc(F)ccc3OC)ncn2)CC1.COc1ccc(F)cc1-c1cc(NC(=O)C(N)c2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)C(c2cccnc2)N2CCNCC2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)Nc2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(N)=O)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCCCC2)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCNCC2)ncn1.Cl.Cl.Cl.O=CC(F)(F)F
InChIInChI=1S/C22H23FN6O2.C18H16FN5O2.C18H22FN5O2.C17H14FN5O2.C17H20N4O2.C16H19N5O2.C12H11FN4O2.C2HF3O.3ClH/c1-31-19-5-4-16(23)11-17(19)18-12-20(27-14-26-18)28-22(30)21(15-3-2-6-25-13-15)29-9-7-24-8-10-29;1-26-15-5-4-12(19)7-13(15)14-8-16(23-10-22-14)24-18(25)17(20)11-3-2-6-21-9-11;1-3-23-6-8-24(9-7-23)18(25)22-17-11-15(20-12-21-17)14-10-13(19)4-5-16(14)26-2;1-25-15-5-4-11(18)7-13(15)14-8-16(21-10-20-14)23-17(24)22-12-3-2-6-19-9-12;1-23-15-8-4-3-7-13(15)14-11-16(19-12-18-14)20-17(22)21-9-5-2-6-10-21;1-23-14-5-3-2-4-12(14)13-10-15(19-11-18-13)20-16(22)21-8-6-17-7-9-21;1-19-10-3-2-7(13)4-8(10)9-5-11(16-6-15-9)17-12(14)18;3-2(4,5)1-6;;;/h2-6,11-14,21,24H,7-10H2,1H3,(H,26,27,28,30);2-10,17H,20H2,1H3,(H,22,23,24,25);4-5,10-12H,3,6-9H2,1-2H3,(H,20,21,22,25);2-10H,1H3,(H2,20,21,22,23,24);3-4,7-8,11-12H,2,5-6,9-10H2,1H3,(H,18,19,20,22);2-5,10-11,17H,6-9H2,1H3,(H,18,19,20,22);2-6H,1H3,(H3,14,15,16,17,18);1H;3*1H
InChIKeyDOSVNVYLVRBFHZ-UHFFFAOYSA-N
MW2569.94 g/mol
LogP18.94
Rot. Bonds28

About 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride

2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride (PubChem CID 158154989) has the molecular formula C122H129Cl3F8N34O15 and a molecular weight of 2569.94 g/mol. Its IUPAC name is 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride.

Molecular Properties

Compound Name2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride
PubChem CID158154989
Molecular FormulaC122H129Cl3F8N34O15
Molecular Weight2569.94 g/mol
Exact Mass2566.93
IUPAC Name2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride
SMILESCCN1CCN(C(=O)Nc2cc(-c3cc(F)ccc3OC)ncn2)CC1.COc1ccc(F)cc1-c1cc(NC(=O)C(N)c2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)C(c2cccnc2)N2CCNCC2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)Nc2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(N)=O)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCCCC2)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCNCC2)ncn1.Cl.Cl.Cl.O=CC(F)(F)F
InChIInChI=1S/C22H23FN6O2.C18H16FN5O2.C18H22FN5O2.C17H14FN5O2.C17H20N4O2.C16H19N5O2.C12H11FN4O2.C2HF3O.3ClH/c1-31-19-5-4-16(23)11-17(19)18-12-20(27-14-26-18)28-22(30)21(15-3-2-6-25-13-15)29-9-7-24-8-10-29;1-26-15-5-4-12(19)7-13(15)14-8-16(23-10-22-14)24-18(25)17(20)11-3-2-6-21-9-11;1-3-23-6-8-24(9-7-23)18(25)22-17-11-15(20-12-21-17)14-10-13(19)4-5-16(14)26-2;1-25-15-5-4-11(18)7-13(15)14-8-16(21-10-20-14)23-17(24)22-12-3-2-6-19-9-12;1-23-15-8-4-3-7-13(15)14-11-16(19-12-18-14)20-17(22)21-9-5-2-6-10-21;1-23-14-5-3-2-4-12(14)13-10-15(19-11-18-13)20-16(22)21-8-6-17-7-9-21;1-19-10-3-2-7(13)4-8(10)9-5-11(16-6-15-9)17-12(14)18;3-2(4,5)1-6;;;/h2-6,11-14,21,24H,7-10H2,1H3,(H,26,27,28,30);2-10,17H,20H2,1H3,(H,22,23,24,25);4-5,10-12H,3,6-9H2,1-2H3,(H,20,21,22,25);2-10H,1H3,(H2,20,21,22,23,24);3-4,7-8,11-12H,2,5-6,9-10H2,1H3,(H,18,19,20,22);2-5,10-11,17H,6-9H2,1H3,(H,18,19,20,22);2-6H,1H3,(H3,14,15,16,17,18);1H;3*1H
InChIKeyDOSVNVYLVRBFHZ-UHFFFAOYSA-N
XLogP18.94
TPSA608.84 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds28
Heavy Atoms182
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002569.94
LogP ≤ 518.94
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride with MolForge

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Related Compounds

2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide
CID 59508965
N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide
CID 59509087
1-[[2-(3-methoxyphenyl)-6-(trifluoromethyl)pyridin-3-yl]methyl]-3-pyridin-3-ylurea;N-[[2-(4-methylpiperidin-1-yl)-6-(trifluoromethyl)pyridin-3-yl]methyl]-2-pyridin-4-ylacetamide
CID 89396940
2-[[2-(3-methoxyphenyl)-6-(trifluoromethyl)-3-pyridinyl]methyl-(pyridin-3-ylcarbamoyl)amino]-N-[[2-(4-methylpiperidin-1-yl)-6-(trifluoromethyl)-3-pyridinyl]methyl]-2-pyridin-4-ylacetamide
CID 89396941
6-[3-[1-[4-[4-[[4-[6-(Ethylamino)-3-pyridinyl]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethoxy]phenyl]-2-[4-(4-methylpiperazin-1-yl)anilino]-8-[[2-(trifluoromethyl)phenyl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 123823727
3-fluoro-N-[[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]methyl]-5-[5-methyl-4-(pyridin-3-ylamino)pyrimidin-2-yl]pyridine-2-carboxamide
CID 135256662
6-fluoro-N-[[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]methyl]-5-[5-methyl-4-(pyridin-3-ylamino)pyrimidin-2-yl]pyridine-2-carboxamide
CID 135256664
3-fluoro-N-[[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]methyl]-5-[4-methyl-6-(pyridin-3-ylamino)pyrimidin-2-yl]pyridine-2-carboxamide
CID 135256679
3,6-difluoro-N-[[6-(6-methoxy-3-pyridinyl)-3-pyridinyl]methyl]-5-[5-methyl-4-(pyridin-3-ylamino)pyrimidin-2-yl]pyridine-2-carboxamide
CID 135256737
2-Amino-3-[[3-[2-amino-1-[[3-[2-amino-4-[2-(difluoromethyl)-4-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-5-oxo-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-5-[4-(difluoromethoxy)-3-methylphenyl]-5-[2-(trifluoromethyl)-4-pyridinyl]imidazol-4-one
CID 137394608
N-[3-(1,1-difluoropropyl)-4-hydroxyphenyl]-4-fluoro-3-[(6-piperidin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)amino]benzamide;4-fluoro-N-[4-methoxy-3-(trifluoromethyl)phenyl]-3-[[6-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]amino]benzamide
CID 143951857
1-[2-[[2-[[2-(4-Acetylpiperazin-1-yl)-6-methoxy-4-pyridinyl]amino]-5-chloropyrimidin-4-yl]amino]-5-methoxyphenyl]but-3-en-2-one;1-[5-fluoro-2-[[2-[(2-methoxy-5-methyl-4-pyridinyl)amino]-5-methylpyrimidin-4-yl]amino]phenyl]but-3-en-2-one;1-[2-[[2-[[2-methoxy-6-(4-methylpiperazin-1-yl)-4-pyridinyl]amino]-5-methylpyrimidin-4-yl]amino]phenyl]but-3-en-2-one;1-[2-[[2-[(2-methoxy-5-methyl-4-pyridinyl)amino]-5-methylpyrimidin-4-yl]amino]-5-(trifluoromethyl)phenyl]but-3-en-2-one;1-[2-[[5-methyl-2-[[2-(methylamino)-4-pyridinyl]amino]pyrimidin-4-yl]amino]phenyl]but-3-en-2-one
CID 157121267

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride?
The IUPAC name of 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride (CID 158154989) is 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride.
What is the SMILES notation for 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride?
The canonical SMILES for 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride is CCN1CCN(C(=O)Nc2cc(-c3cc(F)ccc3OC)ncn2)CC1.COc1ccc(F)cc1-c1cc(NC(=O)C(N)c2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)C(c2cccnc2)N2CCNCC2)ncn1.COc1ccc(F)cc1-c1cc(NC(=O)Nc2cccnc2)ncn1.COc1ccc(F)cc1-c1cc(NC(N)=O)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCCCC2)ncn1.COc1ccccc1-c1cc(NC(=O)N2CCNCC2)ncn1.Cl.Cl.Cl.O=CC(F)(F)F.
What is the InChIKey of 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride?
The InChIKey is DOSVNVYLVRBFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN6O2.C18H16FN5O2.C18H22FN5O2.C17H14FN5O2.C17H20N4O2.C16H19N5O2.C12H11FN4O2.C2HF3O.3ClH/c1-31-19-5-4-16(23)11-17(19)18-12-20(27-14-26-18)28-22(30)21(15-3-2-6-25-13-15)29-9-7-24-8-10-29;1-26-15-5-4-12(19)7-13(15)14-8-16(23-10-22-14)24-18(25)17(20)11-3-2-6-21-9-11;1-3-23-6-8-24(9-7-23)18(25)22-17-11-15(20-12-21-17)14-10-13(19)4-5-16(14)26-2;1-25-15-5-4-11(18)7-13(15)14-8-16(21-10-20-14)23-17(24)22-12-3-2-6-19-9-12;1-23-15-8-4-3-7-13(15)14-11-16(19-12-18-14)20-17(22)21-9-5-2-6-10-21;1-23-14-5-3-2-4-12(14)13-10-15(19-11-18-13)20-16(22)21-8-6-17-7-9-21;1-19-10-3-2-7(13)4-8(10)9-5-11(16-6-15-9)17-12(14)18;3-2(4,5)1-6;;;/h2-6,11-14,21,24H,7-10H2,1H3,(H,26,27,28,30);2-10,17H,20H2,1H3,(H,22,23,24,25);4-5,10-12H,3,6-9H2,1-2H3,(H,20,21,22,25);2-10H,1H3,(H2,20,21,22,23,24);3-4,7-8,11-12H,2,5-6,9-10H2,1H3,(H,18,19,20,22);2-5,10-11,17H,6-9H2,1H3,(H,18,19,20,22);2-6H,1H3,(H3,14,15,16,17,18);1H;3*1H.
What are the key properties of 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride?
2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride has a molecular weight of 2569.94 g/mol, XLogP of 18.94, 28 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide;4-ethyl-N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-piperazin-1-yl-2-pyridin-3-ylacetamide;1-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-3-pyridin-3-ylurea;[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]urea;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperazine-1-carboxamide;N-[6-(2-methoxyphenyl)pyrimidin-4-yl]piperidine-1-carboxamide;2,2,2-trifluoroacetaldehyde;trihydrochloride is sourced from PubChem (CID 158154989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).