2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine

C121H131F4N23O4 — CID 158253146

IUPAC2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine
SMILESCC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCOCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.COc1ccccc1-c1cc(NC2C3CCC(CC3)C2C)nc(-c2c[nH]c3ncc(F)cc23)n1
InChIInChI=1S/C32H35FN6O.C31H33FN6O2.C31H35FN6.C27H28FN5O/c1-19-20-5-9-22(10-6-20)29(19)37-28-16-27(21-7-11-23(12-8-21)32(40)39-13-3-2-4-14-39)36-31(38-28)26-18-35-30-25(26)15-24(33)17-34-30;1-18-19-2-6-21(7-3-19)28(18)36-27-15-26(20-4-8-22(9-5-20)31(39)38-10-12-40-13-11-38)35-30(37-27)25-17-34-29-24(25)14-23(32)16-33-29;1-19-20-5-7-22(8-6-20)29(19)36-28-16-27(21-9-11-24(12-10-21)38-13-3-2-4-14-38)35-31(37-28)26-18-34-30-25(26)15-23(32)17-33-30;1-15-16-7-9-17(10-8-16)25(15)32-24-12-22(19-5-3-4-6-23(19)34-2)31-27(33-24)21-14-30-26-20(21)11-18(28)13-29-26/h7-8,11-12,15-20,22,29H,2-6,9-10,13-14H2,1H3,(H,34,35)(H,36,37,38);4-5,8-9,14-19,21,28H,2-3,6-7,10-13H2,1H3,(H,33,34)(H,35,36,37);9-12,15-20,22,29H,2-8,13-14H2,1H3,(H,33,34)(H,35,36,37);3-6,11-17,25H,7-10H2,1-2H3,(H,29,30)(H,31,32,33)
InChIKeyGGYPELUQYAQFHA-UHFFFAOYSA-N
MW2047.53 g/mol
LogP25.35
Rot. Bonds20

About 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine

2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine (PubChem CID 158253146) has the molecular formula C121H131F4N23O4 and a molecular weight of 2047.53 g/mol. Its IUPAC name is 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine
PubChem CID158253146
Molecular FormulaC121H131F4N23O4
Molecular Weight2047.53 g/mol
Exact Mass2046.07
IUPAC Name2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine
SMILESCC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCOCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.COc1ccccc1-c1cc(NC2C3CCC(CC3)C2C)nc(-c2c[nH]c3ncc(F)cc23)n1
InChIInChI=1S/C32H35FN6O.C31H33FN6O2.C31H35FN6.C27H28FN5O/c1-19-20-5-9-22(10-6-20)29(19)37-28-16-27(21-7-11-23(12-8-21)32(40)39-13-3-2-4-14-39)36-31(38-28)26-18-35-30-25(26)15-24(33)17-34-30;1-18-19-2-6-21(7-3-19)28(18)36-27-15-26(20-4-8-22(9-5-20)31(39)38-10-12-40-13-11-38)35-30(37-27)25-17-34-29-24(25)14-23(32)16-33-29;1-19-20-5-7-22(8-6-20)29(19)36-28-16-27(21-9-11-24(12-10-21)38-13-3-2-4-14-38)35-31(37-28)26-18-34-30-25(26)15-23(32)17-33-30;1-15-16-7-9-17(10-8-16)25(15)32-24-12-22(19-5-3-4-6-23(19)34-2)31-27(33-24)21-14-30-26-20(21)11-18(28)13-29-26/h7-8,11-12,15-20,22,29H,2-6,9-10,13-14H2,1H3,(H,34,35)(H,36,37,38);4-5,8-9,14-19,21,28H,2-3,6-7,10-13H2,1H3,(H,33,34)(H,35,36,37);9-12,15-20,22,29H,2-8,13-14H2,1H3,(H,33,34)(H,35,36,37);3-6,11-17,25H,7-10H2,1-2H3,(H,29,30)(H,31,32,33)
InChIKeyGGYPELUQYAQFHA-UHFFFAOYSA-N
XLogP25.35
TPSA328.28 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds20
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002047.53
LogP ≤ 525.35
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-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

2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(5-morpholin-4-ylfuran-2-yl)pyrimidin-4-amine
CID 159223220
3-[[2-(5,7-difluoro-1H-indol-3-yl)-6-[4-(piperidine-1-carbonyl)phenyl]pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylic acid
CID 134272629
[4-[6-(2-bicyclo[2.2.2]octanylamino)-2-(5,7-difluoro-1H-indol-3-yl)pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone
CID 142287817
6-(3,5-difluorofuran-2-yl)-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-[5-(4-methylpiperazin-1-yl)furan-2-yl]pyrimidin-4-amine;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(5-morpholin-4-ylfuran-2-yl)pyrimidin-4-amine;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(5-pyrrolidin-1-ylfuran-2-yl)pyrimidin-4-amine;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(5-pyrrol-1-ylfuran-2-yl)pyrimidin-4-amine
CID 159223218
[4-[5-[4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]-morpholin-4-ylmethanone
CID 146274494
[4-[5-[4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]-piperidin-1-ylmethanone
CID 146274420
3-[[6-cyclopropyl-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylic acid
CID 129228683
2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-phenylquinazolin-4-amine
CID 158151599
3-[[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(4,5,6,7-tetrahydro-1-benzofuran-2-yl)pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylic acid
CID 129228809
2-(5-fluoro-6-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-phenylpyrimidin-4-amine
CID 157189486
(2S,3S)-3-[[2-(5,7-difluoro-1H-indol-3-yl)-6-(4-fluorophenyl)pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylic acid
CID 134272784
methyl 3-[[2-chloro-6-(4-morpholin-4-ylphenyl)pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylate
CID 171853076

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine?
The IUPAC name of 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine (CID 158253146) is 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine?
The canonical SMILES for 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine is CC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(C(=O)N3CCOCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.CC1C2CCC(CC2)C1Nc1cc(-c2ccc(N3CCCCC3)cc2)nc(-c2c[nH]c3ncc(F)cc23)n1.COc1ccccc1-c1cc(NC2C3CCC(CC3)C2C)nc(-c2c[nH]c3ncc(F)cc23)n1.
What is the InChIKey of 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine?
The InChIKey is GGYPELUQYAQFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H35FN6O.C31H33FN6O2.C31H35FN6.C27H28FN5O/c1-19-20-5-9-22(10-6-20)29(19)37-28-16-27(21-7-11-23(12-8-21)32(40)39-13-3-2-4-14-39)36-31(38-28)26-18-35-30-25(26)15-24(33)17-34-30;1-18-19-2-6-21(7-3-19)28(18)36-27-15-26(20-4-8-22(9-5-20)31(39)38-10-12-40-13-11-38)35-30(37-27)25-17-34-29-24(25)14-23(32)16-33-29;1-19-20-5-7-22(8-6-20)29(19)36-28-16-27(21-9-11-24(12-10-21)38-13-3-2-4-14-38)35-31(37-28)26-18-34-30-25(26)15-23(32)17-33-30;1-15-16-7-9-17(10-8-16)25(15)32-24-12-22(19-5-3-4-6-23(19)34-2)31-27(33-24)21-14-30-26-20(21)11-18(28)13-29-26/h7-8,11-12,15-20,22,29H,2-6,9-10,13-14H2,1H3,(H,34,35)(H,36,37,38);4-5,8-9,14-19,21,28H,2-3,6-7,10-13H2,1H3,(H,33,34)(H,35,36,37);9-12,15-20,22,29H,2-8,13-14H2,1H3,(H,33,34)(H,35,36,37);3-6,11-17,25H,7-10H2,1-2H3,(H,29,30)(H,31,32,33).
What are the key properties of 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine?
2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine has a molecular weight of 2047.53 g/mol, XLogP of 25.35, 20 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(2-methoxyphenyl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-morpholin-4-ylmethanone;[4-[2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-[(3-methyl-2-bicyclo[2.2.2]octanyl)amino]pyrimidin-4-yl]phenyl]-piperidin-1-ylmethanone;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(4-piperidin-1-ylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 158253146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).