[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone

C153H212F6N26O15 — CID 157237072

IUPAC[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone
SMILESCc1c(CCCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCC2CCC(C(F)(F)F)CC2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C27H38N4O2.C26H36N4O3.C26H36N4O2.C25H32F3N5O3.C25H34N4O3.C24H36F3N5O2/c1-21-25(11-7-3-6-10-22-8-4-2-5-9-22)28-20-29-26(21)27(33)31-16-12-23(13-17-31)30-18-14-24(32)15-19-30;1-20-24(8-5-17-33-18-21-6-3-2-4-7-21)27-19-28-25(20)26(32)30-13-9-22(10-14-30)29-15-11-23(31)12-16-29;1-20-24(10-6-5-9-21-7-3-2-4-8-21)27-19-28-25(20)26(32)30-15-11-22(12-16-30)29-17-13-23(31)14-18-29;1-17-22(24(35)33-12-7-19(8-13-33)32-14-9-20(34)10-15-32)30-16-31-23(17)29-11-6-18-2-4-21(5-3-18)36-25(26,27)28;1-19-23(8-5-17-32-22-6-3-2-4-7-22)26-18-27-24(19)25(31)29-13-9-20(10-14-29)28-15-11-21(30)12-16-28;1-16-21(23(34)32-10-6-19(7-11-32)31-12-8-20(33)9-13-31)29-15-30-22(16)28-14-17-2-4-18(5-3-17)24(25,26)27/h2,4-5,8-9,20,23-24,32H,3,6-7,10-19H2,1H3;2-4,6-7,19,22-23,31H,5,8-18H2,1H3;2-4,7-8,19,22-23,31H,5-6,9-18H2,1H3;2-5,16,19-20,34H,6-15H2,1H3,(H,29,30,31);2-4,6-7,18,20-21,30H,5,8-17H2,1H3;15,17-20,33H,2-14H2,1H3,(H,28,29,30)
InChIKeyAUTIVZCROUKVEM-UHFFFAOYSA-N
MW2769.53 g/mol
LogP20.09
Rot. Bonds42

About [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone

[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone (PubChem CID 157237072) has the molecular formula C153H212F6N26O15 and a molecular weight of 2769.53 g/mol. Its IUPAC name is [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone.

Molecular Properties

Compound Name[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone
PubChem CID157237072
Molecular FormulaC153H212F6N26O15
Molecular Weight2769.53 g/mol
Exact Mass2767.65
IUPAC Name[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone
SMILESCc1c(CCCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCC2CCC(C(F)(F)F)CC2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C27H38N4O2.C26H36N4O3.C26H36N4O2.C25H32F3N5O3.C25H34N4O3.C24H36F3N5O2/c1-21-25(11-7-3-6-10-22-8-4-2-5-9-22)28-20-29-26(21)27(33)31-16-12-23(13-17-31)30-18-14-24(32)15-19-30;1-20-24(8-5-17-33-18-21-6-3-2-4-7-21)27-19-28-25(20)26(32)30-13-9-22(10-14-30)29-15-11-23(31)12-16-29;1-20-24(10-6-5-9-21-7-3-2-4-8-21)27-19-28-25(20)26(32)30-15-11-22(12-16-30)29-17-13-23(31)14-18-29;1-17-22(24(35)33-12-7-19(8-13-33)32-14-9-20(34)10-15-32)30-16-31-23(17)29-11-6-18-2-4-21(5-3-18)36-25(26,27)28;1-19-23(8-5-17-32-22-6-3-2-4-7-22)26-18-27-24(19)25(31)29-13-9-20(10-14-29)28-15-11-21(30)12-16-28;1-16-21(23(34)32-10-6-19(7-11-32)31-12-8-20(33)9-13-31)29-15-30-22(16)28-14-17-2-4-18(5-3-17)24(25,26)27/h2,4-5,8-9,20,23-24,32H,3,6-7,10-19H2,1H3;2-4,6-7,19,22-23,31H,5,8-18H2,1H3;2-4,7-8,19,22-23,31H,5-6,9-18H2,1H3;2-5,16,19-20,34H,6-15H2,1H3,(H,29,30,31);2-4,6-7,18,20-21,30H,5,8-17H2,1H3;15,17-20,33H,2-14H2,1H3,(H,28,29,30)
InChIKeyAUTIVZCROUKVEM-UHFFFAOYSA-N
XLogP20.09
TPSA469.11 Ų
H-Bond Donors8
H-Bond Acceptors35
Rotatable Bonds42
Heavy Atoms200
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002769.53
LogP ≤ 520.09
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone 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

[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethyl)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]-(4-spiro[3H-1-benzofuran-2,4'-piperidine]-1'-ylpiperidin-1-yl)methanone
CID 58035159
[4-[[(3S,4S)-3-methoxyoxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035182
[4-[[(3S,4S)-3-methoxyoxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2S,6R)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035255
[4-[[(3S,4S)-3-fluorooxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035281
[4-[(3-fluorooxan-4-yl)amino]piperidin-1-yl]-[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035292
[4-[[(3R,4R)-3-methoxyoxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2S,6R)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035333
[4-[[(3R,4R)-3-methoxyoxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035344
[4-[[(3R,4R)-3-fluorooxan-4-yl]amino]piperidin-1-yl]-[5-methyl-6-[2-[(2R,6S)-6-[4-(trifluoromethoxy)phenyl]oxan-2-yl]ethyl]pyrimidin-4-yl]methanone
CID 58035373
[4-(4-Hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone
CID 68054580
[6-[(4-Tert-butylphenyl)methylamino]-5-methylpyrimidin-4-yl]-[4-[4-(3,4-difluorophenoxy)piperidin-1-yl]piperidin-1-yl]methanone
CID 68071122
[5-methyl-6-[[(2R,6S)-6-[4-(trifluoromethyl)phenyl]oxan-2-yl]methylamino]pyrimidin-4-yl]-(4-spiro[3H-1-benzofuran-2,4'-piperidine]-1'-ylpiperidin-1-yl)methanone
CID 68494775
[5-methyl-6-[[6-[4-(trifluoromethyl)phenyl]oxan-2-yl]methylamino]pyrimidin-4-yl]-(4-spiro[3H-1-benzofuran-2,4'-piperidine]-1'-ylpiperidin-1-yl)methanone
CID 77505667

Frequently Asked Questions

What is the IUPAC name of [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone?
The IUPAC name of [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone (CID 157237072) is [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone.
What is the SMILES notation for [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone?
The canonical SMILES for [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone is Cc1c(CCCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOCc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCOc2ccccc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCC2CCC(C(F)(F)F)CC2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(NCCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.
What is the InChIKey of [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone?
The InChIKey is AUTIVZCROUKVEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H38N4O2.C26H36N4O3.C26H36N4O2.C25H32F3N5O3.C25H34N4O3.C24H36F3N5O2/c1-21-25(11-7-3-6-10-22-8-4-2-5-9-22)28-20-29-26(21)27(33)31-16-12-23(13-17-31)30-18-14-24(32)15-19-30;1-20-24(8-5-17-33-18-21-6-3-2-4-7-21)27-19-28-25(20)26(32)30-13-9-22(10-14-30)29-15-11-23(31)12-16-29;1-20-24(10-6-5-9-21-7-3-2-4-8-21)27-19-28-25(20)26(32)30-15-11-22(12-16-30)29-17-13-23(31)14-18-29;1-17-22(24(35)33-12-7-19(8-13-33)32-14-9-20(34)10-15-32)30-16-31-23(17)29-11-6-18-2-4-21(5-3-18)36-25(26,27)28;1-19-23(8-5-17-32-22-6-3-2-4-7-22)26-18-27-24(19)25(31)29-13-9-20(10-14-29)28-15-11-21(30)12-16-28;1-16-21(23(34)32-10-6-19(7-11-32)31-12-8-20(33)9-13-31)29-15-30-22(16)28-14-17-2-4-18(5-3-17)24(25,26)27/h2,4-5,8-9,20,23-24,32H,3,6-7,10-19H2,1H3;2-4,6-7,19,22-23,31H,5,8-18H2,1H3;2-4,7-8,19,22-23,31H,5-6,9-18H2,1H3;2-5,16,19-20,34H,6-15H2,1H3,(H,29,30,31);2-4,6-7,18,20-21,30H,5,8-17H2,1H3;15,17-20,33H,2-14H2,1H3,(H,28,29,30).
What are the key properties of [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone?
[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone has a molecular weight of 2769.53 g/mol, XLogP of 20.09, 42 rotatable bonds, 8 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone is sourced from PubChem (CID 157237072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).