5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide

C52H42N10O4 — CID 123537302

IUPAC5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1.Cc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1
InChIInChI=1S/2C26H21N5O2/c2*1-17-14-23(33-21-9-11-27-12-10-21)24(28-15-17)26(32)29-20-7-5-19(6-8-20)22-16-31-13-3-4-18(2)25(31)30-22/h2*3-16H,1-2H3,(H,29,32)
InChIKeyLIRPPTVELXGFDH-UHFFFAOYSA-N
MW870.97 g/mol
LogP10.91
Rot. Bonds10

About 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide

5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide (PubChem CID 123537302) has the molecular formula C52H42N10O4 and a molecular weight of 870.97 g/mol. Its IUPAC name is 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide
PubChem CID123537302
Molecular FormulaC52H42N10O4
Molecular Weight870.97 g/mol
Exact Mass870.34
IUPAC Name5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1.Cc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1
InChIInChI=1S/2C26H21N5O2/c2*1-17-14-23(33-21-9-11-27-12-10-21)24(28-15-17)26(32)29-20-7-5-19(6-8-20)22-16-31-13-3-4-18(2)25(31)30-22/h2*3-16H,1-2H3,(H,29,32)
InChIKeyLIRPPTVELXGFDH-UHFFFAOYSA-N
XLogP10.91
TPSA162.82 Ų
H-Bond Donors2
H-Bond Acceptors12
Rotatable Bonds10
Heavy Atoms66
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500870.97
LogP ≤ 510.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1012

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Related Compounds

N-[5-(3-fluoropiperidin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118224310
N-[5-(4-fluoropiperidin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118224353
2-(2-methyl-4-pyridinyl)-N-(2-morpholin-4-yl-5-piperidin-1-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl)-1,3-oxazole-4-carboxamide
CID 118224356
N-[5-(4-hydroxypiperidin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118224418
6-(6-amino-3-pyridinyl)-N-(2-morpholin-4-yl-5-piperidin-1-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl)pyridine-2-carboxamide
CID 124196707
N-[4-(2,3-dimethylimidazo[1,2-a]pyridin-5-yl)-6-[2-(methylamino)propanoylamino]-2-pyridinyl]-5-methoxypyridine-2-carboxamide
CID 117902661
N-ethyl-5-[2-methyl-8-[(2-phenylphenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]pyridine-2-carboxamide;hydrochloride
CID 156022060
N-ethyl-5-(2-methyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)pyridine-2-carboxamide;hydrochloride
CID 156022149
N-[5-(3-ethyl-3-hydroxypiperidin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 162642971
N-benzyl-N-methyl-3-({[3-(pyridin-3-yloxy)propyl]amino}methyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 16191852
N-ethyl-5-(8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)pyridine-2-carboxamide
CID 156010829
N-ethyl-5-[2-(methoxymethyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl]pyridine-2-carboxamide;hydrochloride
CID 156013110

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide?
The IUPAC name of 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide (CID 123537302) is 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide is Cc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1.Cc1cnc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccncc2)c1.
What is the InChIKey of 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide?
The InChIKey is LIRPPTVELXGFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H21N5O2/c2*1-17-14-23(33-21-9-11-27-12-10-21)24(28-15-17)26(32)29-20-7-5-19(6-8-20)22-16-31-13-3-4-18(2)25(31)30-22/h2*3-16H,1-2H3,(H,29,32).
What are the key properties of 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide?
5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide has a molecular weight of 870.97 g/mol, XLogP of 10.91, 10 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-pyridin-4-yloxypyridine-2-carboxamide is sourced from PubChem (CID 123537302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).