N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile

C159H127F6N27O3 — CID 157157315

IUPACN-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile
SMILESCOc1ccc(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(C)c4)cc23)cc1.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CCCC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C#N)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C(N)=O)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)ccc1F
InChIInChI=1S/C30H26FN5O.C27H20FN5O.C27H18FN5.C27H21FN4O.C25H23FN4.C23H19FN4/c1-20-17-22(4-10-27(20)31)29-25(3-2-12-32-29)21-5-11-28-26(18-21)30(34-19-33-28)35-23-6-8-24(9-7-23)36-13-15-37-16-14-36;1-16-13-19(6-10-23(16)28)25-21(3-2-12-30-25)18-7-11-24-22(14-18)27(32-15-31-24)33-20-8-4-17(5-9-20)26(29)34;1-17-13-20(6-10-24(17)28)26-22(3-2-12-30-26)19-7-11-25-23(14-19)27(32-16-31-25)33-21-8-4-18(15-29)5-9-21;1-17-14-19(5-11-24(17)28)26-22(4-3-13-29-26)18-6-12-25-23(15-18)27(31-16-30-25)32-20-7-9-21(33-2)10-8-20;1-16-13-18(8-10-22(16)26)24-20(7-4-12-27-24)17-9-11-23-21(14-17)25(29-15-28-23)30-19-5-2-3-6-19;1-14-11-16(4-8-20(14)24)22-18(3-2-10-25-22)15-5-9-21-19(12-15)23(27-13-26-21)28-17-6-7-17/h2-12,17-19H,13-16H2,1H3,(H,33,34,35);2-15H,1H3,(H2,29,34)(H,31,32,33);2-14,16H,1H3,(H,31,32,33);3-16H,1-2H3,(H,30,31,32);4,7-15,19H,2-3,5-6H2,1H3,(H,28,29,30);2-5,8-13,17H,6-7H2,1H3,(H,26,27,28)
InChIKeyALYQYLGROBTTQN-UHFFFAOYSA-N
MW2577.94 g/mol
LogP36.56
Rot. Bonds27

About N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile

N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile (PubChem CID 157157315) has the molecular formula C159H127F6N27O3 and a molecular weight of 2577.94 g/mol. Its IUPAC name is N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile.

Molecular Properties

Compound NameN-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile
PubChem CID157157315
Molecular FormulaC159H127F6N27O3
Molecular Weight2577.94 g/mol
Exact Mass2576.05
IUPAC NameN-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile
SMILESCOc1ccc(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(C)c4)cc23)cc1.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CCCC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C#N)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C(N)=O)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)ccc1F
InChIInChI=1S/C30H26FN5O.C27H20FN5O.C27H18FN5.C27H21FN4O.C25H23FN4.C23H19FN4/c1-20-17-22(4-10-27(20)31)29-25(3-2-12-32-29)21-5-11-28-26(18-21)30(34-19-33-28)35-23-6-8-24(9-7-23)36-13-15-37-16-14-36;1-16-13-19(6-10-23(16)28)25-21(3-2-12-30-25)18-7-11-24-22(14-18)27(32-15-31-24)33-20-8-4-17(5-9-20)26(29)34;1-17-13-20(6-10-24(17)28)26-22(3-2-12-30-26)19-7-11-25-23(14-19)27(32-16-31-25)33-21-8-4-18(15-29)5-9-21;1-17-14-19(5-11-24(17)28)26-22(4-3-13-29-26)18-6-12-25-23(15-18)27(31-16-30-25)32-20-7-9-21(33-2)10-8-20;1-16-13-18(8-10-22(16)26)24-20(7-4-12-27-24)17-9-11-23-21(14-17)25(29-15-28-23)30-19-5-2-3-6-19;1-14-11-16(4-8-20(14)24)22-18(3-2-10-25-22)15-5-9-21-19(12-15)23(27-13-26-21)28-17-6-7-17/h2-12,17-19H,13-16H2,1H3,(H,33,34,35);2-15H,1H3,(H2,29,34)(H,31,32,33);2-14,16H,1H3,(H,31,32,33);3-16H,1-2H3,(H,30,31,32);4,7-15,19H,2-3,5-6H2,1H3,(H,28,29,30);2-5,8-13,17H,6-7H2,1H3,(H,26,27,28)
InChIKeyALYQYLGROBTTQN-UHFFFAOYSA-N
XLogP36.56
TPSA392.78 Ų
H-Bond Donors7
H-Bond Acceptors29
Rotatable Bonds27
Heavy Atoms195
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002577.94
LogP ≤ 536.56
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile with MolForge

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Related Compounds

3-[3-[2-[4-[[4-[(9aS)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazin-8-yl]piperidin-1-yl]methoxy]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]-N-(2,6-difluorophenyl)benzamide
CID 71147569
N-[(3-tert-butylphenyl)methyl]-3-[[6-[2-(dimethylamino)ethyl-methylamino]-1-[[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbamoyl]-2-[[1-[[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbamoyl]-2-[[6-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]amino]phenyl]methyl]-6-morpholin-4-ylpyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]phenyl]methyl]pyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]-4-methylbenzamide
CID 90936133
8-[(2S)-1-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]-3-fluoro-N-methylquinoline-4-carboxamide
CID 118982873
8-[(2S)-1-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide
CID 118982878
8-[2-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]ethyl]-5-fluoro-N-methylquinoline-4-carboxamide
CID 123340388
8-[4-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]-3-methylbutan-2-yl]-3-fluoro-N-methylquinoline-4-carboxamide
CID 123466270
8-[(3S)-4-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]-3-methylbutan-2-yl]-5-fluoro-N-methylquinoline-4-carboxamide
CID 130428845
8-[2-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]ethyl]-3-fluoro-N-methylquinoline-4-carboxamide
CID 134289286
8-[(3S)-4-[[6-(6-cyano-5-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]-3-methylbutan-2-yl]-3-fluoro-N-methylquinoline-4-carboxamide
CID 144832050
5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(5-fluoro-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157176480
N-[4-[chloro(difluoro)methoxy]phenyl]-5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]pyridine-3-carboxamide;5-(5-cyano-3-pyridinyl)-6-[ethyl(2-hydroxyethyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(2-hydroxyethylamino)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157187034
N-[1-[4-[6-(6-cyclopropyl-3-pyridinyl)-7H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]ethenyl]-4-(trifluoromethoxy)aniline;3-[4-[4-[1-[(4-fluorophenyl)methylamino]ethenyl]piperazin-1-yl]-7H-cyclopenta[d]pyrimidin-6-yl]benzamide;3-[4-[4-[1-[(4-fluorophenyl)methylamino]ethenyl]piperazin-1-yl]-7H-cyclopenta[d]pyrimidin-6-yl]benzonitrile;4-[4-[4-[1-[(4-fluorophenyl)methylamino]ethenyl]piperazin-1-yl]-7H-cyclopenta[d]pyrimidin-6-yl]benzonitrile
CID 157374372

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile?
The IUPAC name of N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile (CID 157157315) is N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile.
What is the SMILES notation for N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile?
The canonical SMILES for N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile is COc1ccc(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(C)c4)cc23)cc1.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(NC4CCCC4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C#N)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(C(N)=O)cc4)c3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)ccc1F.
What is the InChIKey of N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile?
The InChIKey is ALYQYLGROBTTQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26FN5O.C27H20FN5O.C27H18FN5.C27H21FN4O.C25H23FN4.C23H19FN4/c1-20-17-22(4-10-27(20)31)29-25(3-2-12-32-29)21-5-11-28-26(18-21)30(34-19-33-28)35-23-6-8-24(9-7-23)36-13-15-37-16-14-36;1-16-13-19(6-10-23(16)28)25-21(3-2-12-30-25)18-7-11-24-22(14-18)27(32-15-31-24)33-20-8-4-17(5-9-20)26(29)34;1-17-13-20(6-10-24(17)28)26-22(3-2-12-30-26)19-7-11-25-23(14-19)27(32-16-31-25)33-21-8-4-18(15-29)5-9-21;1-17-14-19(5-11-24(17)28)26-22(4-3-13-29-26)18-6-12-25-23(15-18)27(31-16-30-25)32-20-7-9-21(33-2)10-8-20;1-16-13-18(8-10-22(16)26)24-20(7-4-12-27-24)17-9-11-23-21(14-17)25(29-15-28-23)30-19-5-2-3-6-19;1-14-11-16(4-8-20(14)24)22-18(3-2-10-25-22)15-5-9-21-19(12-15)23(27-13-26-21)28-17-6-7-17/h2-12,17-19H,13-16H2,1H3,(H,33,34,35);2-15H,1H3,(H2,29,34)(H,31,32,33);2-14,16H,1H3,(H,31,32,33);3-16H,1-2H3,(H,30,31,32);4,7-15,19H,2-3,5-6H2,1H3,(H,28,29,30);2-5,8-13,17H,6-7H2,1H3,(H,26,27,28).
What are the key properties of N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile?
N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile has a molecular weight of 2577.94 g/mol, XLogP of 36.56, 27 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;N-cyclopropyl-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-methoxyphenyl)quinazolin-4-amine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzamide;4-[[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]quinazolin-4-yl]amino]benzonitrile is sourced from PubChem (CID 157157315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).