N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide

C18H17ClN4O3 — CID 4782515

IUPACN-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C18H17ClN4O3/c1-22(18(25)14-10-23-8-4-3-5-16(23)20-14)11-17(24)21-13-9-12(19)6-7-15(13)26-2/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeyKSEKZEUEZMRTCH-UHFFFAOYSA-N
MW372.81 g/mol
LogP2.71
Rot. Bonds5

About N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 4782515) has the molecular formula C18H17ClN4O3 and a molecular weight of 372.81 g/mol. Its IUPAC name is N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID4782515
Molecular FormulaC18H17ClN4O3
Molecular Weight372.81 g/mol
Exact Mass372.10
IUPAC NameN-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C18H17ClN4O3/c1-22(18(25)14-10-23-8-4-3-5-16(23)20-14)11-17(24)21-13-9-12(19)6-7-15(13)26-2/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeyKSEKZEUEZMRTCH-UHFFFAOYSA-N
XLogP2.71
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[4-[(5-Chloro-4-imidazo[1,2-a]pyridin-3-yl-pyrimidin-2-yl)amino]-3-methoxy-phenyl]piperazin-1-yl]ethanone
CID 53380818
N-{(2R)-3-[4-(3,4-Dichlorophenoxy)piperidin-1-yl]-2-hydroxypropyl}-6-fluoroimidazo[1,2-a]pyridine-2-carboxamide
CID 59296114
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 11675867
9-(5-Chloro-2-methoxyphenyl)-4-[4-(4-methylpiperazin-1-yl)anilino]-1,3,5,9,11-pentazatetracyclo[8.7.0.02,7.012,17]heptadeca-2,4,6,10,12,14,16-heptaen-8-one
CID 11169051
1-(5-Chloro-2-methoxyphenyl)-3-(3-(8-(pyridin-4-ylmethylamino)imidazo[1,2-a]pyrazin-6-yl)phenyl)urea
CID 11584176
1-[4-[4-[(5-Chloro-4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]-3-methoxyphenyl]-1,4-diazepan-1-yl]ethanone
CID 45380509
4-(4-(5-Chloro-4-(imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-ylamino)-3-methoxyphenyl)piperazin-2-one
CID 45381216
2-(4-(4-(5-chloro-4-(imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-ylamino)-3-methoxyphenyl)piperazin-1-yl)-N,N-dimethylacetamide
CID 56663565
1-[4-[3-[(5-Chloro-4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]-4-methoxyphenyl]piperazin-1-yl]ethanone
CID 56663567
1-[4-[4-[(5-Chloro-4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]-3-methoxyphenyl]piperazin-1-yl]-2-(methylamino)ethanone
CID 56677276
1-[4-[4-[[5-Chloro-4-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-3-methoxyphenyl]piperazin-1-yl]ethanone
CID 56683652
N-[[4-(4-chlorophenoxy)phenyl]methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 71761820

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 4782515) is N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide is COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1cn2ccccc2n1.
What is the InChIKey of N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is KSEKZEUEZMRTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O3/c1-22(18(25)14-10-23-8-4-3-5-16(23)20-14)11-17(24)21-13-9-12(19)6-7-15(13)26-2/h3-10H,11H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 372.81 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 4782515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).