1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide

C73H77Cl4F3N24O4S — CID 158928703

IUPAC1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide
SMILESCC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.CC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4ccc(Cl)cn34)n2)C1.CS(C)(=O)=NC1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.NC(=O)[C@H]1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1
InChIInChI=1S/C19H20ClFN6O.C19H21ClN6O.C18H20ClFN6OS.C17H16ClFN6O/c1-10-5-12(18(22)28)11(2)26(8-10)16-3-4-23-19(25-16)15-7-24-17-6-14(21)13(20)9-27(15)17;1-11-7-14(18(21)27)12(2)25(9-11)17-5-6-22-19(24-17)15-8-23-16-4-3-13(20)10-26(15)16;1-28(2,27)24-12-4-3-7-25(10-12)16-5-6-21-18(23-16)15-9-22-17-8-14(20)13(19)11-26(15)17;18-11-9-25-13(7-22-15(25)6-12(11)19)17-21-4-3-14(23-17)24-5-1-2-10(8-24)16(20)26/h3-4,6-7,9-12H,5,8H2,1-2H3,(H2,22,28);3-6,8,10-12,14H,7,9H2,1-2H3,(H2,21,27);5-6,8-9,11-12H,3-4,7,10H2,1-2H3;3-4,6-7,9-10H,1-2,5,8H2,(H2,20,26)/t;;;10-/m...0/s1
InChIKeyJITPTKMYRCZQMR-XJTQBUAMSA-N
MW1585.46 g/mol
LogP11.27
Rot. Bonds12

About 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide

1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide (PubChem CID 158928703) has the molecular formula C73H77Cl4F3N24O4S and a molecular weight of 1585.46 g/mol. Its IUPAC name is 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide
PubChem CID158928703
Molecular FormulaC73H77Cl4F3N24O4S
Molecular Weight1585.46 g/mol
Exact Mass1582.50
IUPAC Name1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide
SMILESCC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.CC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4ccc(Cl)cn34)n2)C1.CS(C)(=O)=NC1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.NC(=O)[C@H]1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1
InChIInChI=1S/C19H20ClFN6O.C19H21ClN6O.C18H20ClFN6OS.C17H16ClFN6O/c1-10-5-12(18(22)28)11(2)26(8-10)16-3-4-23-19(25-16)15-7-24-17-6-14(21)13(20)9-27(15)17;1-11-7-14(18(21)27)12(2)25(9-11)17-5-6-22-19(24-17)15-8-23-16-4-3-13(20)10-26(15)16;1-28(2,27)24-12-4-3-7-25(10-12)16-5-6-21-18(23-16)15-9-22-17-8-14(20)13(19)11-26(15)17;18-11-9-25-13(7-22-15(25)6-12(11)19)17-21-4-3-14(23-17)24-5-1-2-10(8-24)16(20)26/h3-4,6-7,9-12H,5,8H2,1-2H3,(H2,22,28);3-6,8,10-12,14H,7,9H2,1-2H3,(H2,21,27);5-6,8-9,11-12H,3-4,7,10H2,1-2H3;3-4,6-7,9-10H,1-2,5,8H2,(H2,20,26)/t;;;10-/m...0/s1
InChIKeyJITPTKMYRCZQMR-XJTQBUAMSA-N
XLogP11.27
TPSA343.98 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds12
Heavy Atoms109
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001585.46
LogP ≤ 511.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Analyze 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide 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-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide
CID 139356979
1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide
CID 139344807
[(3S,5R)-1-[2-(6-cyclopropyl-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-5-methylpiperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane
CID 139350665
(3S)-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide
CID 139344396
(3S)-1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide
CID 139358253
1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide
CID 139357749
3-[4-[(3R,5S)-3-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-5-methylpiperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyridine-6-sulfonamide
CID 139344353
(3R,5R)-1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-5-methylpiperidin-3-amine
CID 139344427
[(3R,5S)-1-[2-[6-(cyclopropylmethylsulfonyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]-5-methylpiperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane
CID 160562254
(3S,4R)-3-amino-1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-4-ol
CID 139357007
[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-3-phenylpiperidin-4-yl]methanol
CID 139344346
(2R,6S)-4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-methyl-6-(5-methyl-1H-pyrazol-4-yl)morpholine
CID 139344284

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide?
The IUPAC name of 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide (CID 158928703) is 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide?
The canonical SMILES for 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide is CC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.CC1CC(C(N)=O)C(C)N(c2ccnc(-c3cnc4ccc(Cl)cn34)n2)C1.CS(C)(=O)=NC1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.NC(=O)[C@H]1CCCN(c2ccnc(-c3cnc4cc(F)c(Cl)cn34)n2)C1.
What is the InChIKey of 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide?
The InChIKey is JITPTKMYRCZQMR-XJTQBUAMSA-N. The full InChI is InChI=1S/C19H20ClFN6O.C19H21ClN6O.C18H20ClFN6OS.C17H16ClFN6O/c1-10-5-12(18(22)28)11(2)26(8-10)16-3-4-23-19(25-16)15-7-24-17-6-14(21)13(20)9-27(15)17;1-11-7-14(18(21)27)12(2)25(9-11)17-5-6-22-19(24-17)15-8-23-16-4-3-13(20)10-26(15)16;1-28(2,27)24-12-4-3-7-25(10-12)16-5-6-21-18(23-16)15-9-22-17-8-14(20)13(19)11-26(15)17;18-11-9-25-13(7-22-15(25)6-12(11)19)17-21-4-3-14(23-17)24-5-1-2-10(8-24)16(20)26/h3-4,6-7,9-12H,5,8H2,1-2H3,(H2,22,28);3-6,8,10-12,14H,7,9H2,1-2H3,(H2,21,27);5-6,8-9,11-12H,3-4,7,10H2,1-2H3;3-4,6-7,9-10H,1-2,5,8H2,(H2,20,26)/t;;;10-/m...0/s1.
What are the key properties of 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide?
1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide has a molecular weight of 1585.46 g/mol, XLogP of 11.27, 12 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide;(3S)-1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidine-3-carboxamide;[1-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]piperidin-3-yl]imino-dimethyl-oxo-λ6-sulfane;1-[2-(6-chloroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2,5-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 158928703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).