1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide

C22H26N4O3 — CID 172666762

IUPAC1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCc1ccn(C2CCC(O)CC2)c(=O)c1C(=O)NCCc1cn2ccccc2n1
InChIInChI=1S/C22H26N4O3/c1-15-10-13-26(17-5-7-18(27)8-6-17)22(29)20(15)21(28)23-11-9-16-14-25-12-3-2-4-19(25)24-16/h2-4,10,12-14,17-18,27H,5-9,11H2,1H3,(H,23,28)
InChIKeyHTVVLZRZXINFKA-UHFFFAOYSA-N
MW394.48 g/mol
LogP2.25
Rot. Bonds5

About 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide

1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide (PubChem CID 172666762) has the molecular formula C22H26N4O3 and a molecular weight of 394.48 g/mol. Its IUPAC name is 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide
PubChem CID172666762
Molecular FormulaC22H26N4O3
Molecular Weight394.48 g/mol
Exact Mass394.20
IUPAC Name1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCc1ccn(C2CCC(O)CC2)c(=O)c1C(=O)NCCc1cn2ccccc2n1
InChIInChI=1S/C22H26N4O3/c1-15-10-13-26(17-5-7-18(27)8-6-17)22(29)20(15)21(28)23-11-9-16-14-25-12-3-2-4-19(25)24-16/h2-4,10,12-14,17-18,27H,5-9,11H2,1H3,(H,23,28)
InChIKeyHTVVLZRZXINFKA-UHFFFAOYSA-N
XLogP2.25
TPSA88.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-methylthiophene-2-carboxamide
CID 31008232
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methyl-5-methylsulfanylbenzamide
CID 37275406
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-[(2R)-morpholin-2-yl]acetamide
CID 125163664
4-fluoro-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 25429046
4-(dimethylamino)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 25429154
3-(cyclopropanecarbonylamino)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)naphthalene-2-carboxamide
CID 25430851
5-(2-imidazo[1,2-a]pyridin-2-ylethylcarbamoyl)-1-methylpiperidine-2-carboxylic acid
CID 167894308
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3,5-dimethoxybenzamide
CID 41463533
trans-methyl (1S,2S)-2-(2-imidazo[1,2-a]pyridin-2-ylethylcarbamoyl)cyclopentane-1-carboxylate
CID 97340572
formic acid;N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1,1-dioxothiolane-3-carboxamide
CID 154904325
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)thiophene-3-carboxamide
CID 32834557
2-benzoyl-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)benzamide
CID 25430937

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide (CID 172666762) is 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide is Cc1ccn(C2CCC(O)CC2)c(=O)c1C(=O)NCCc1cn2ccccc2n1.
What is the InChIKey of 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is HTVVLZRZXINFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3/c1-15-10-13-26(17-5-7-18(27)8-6-17)22(29)20(15)21(28)23-11-9-16-14-25-12-3-2-4-19(25)24-16/h2-4,10,12-14,17-18,27H,5-9,11H2,1H3,(H,23,28).
What are the key properties of 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide?
1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxycyclohexyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172666762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).