2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide

C27H34N4O3 — CID 70862354

IUPAC2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
SMILESCOC1CCCCN1C(=O)c1cn2c(C(=O)NCC(CC(C)C)c3ccccc3)cccc2n1
InChIInChI=1S/C27H34N4O3/c1-19(2)16-21(20-10-5-4-6-11-20)17-28-26(32)23-12-9-13-24-29-22(18-31(23)24)27(33)30-15-8-7-14-25(30)34-3/h4-6,9-13,18-19,21,25H,7-8,14-17H2,1-3H3,(H,28,32)
InChIKeyYXECTNDVBNRRJZ-UHFFFAOYSA-N
MW462.59 g/mol
LogP4.49
Rot. Bonds8

About 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide

2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide (PubChem CID 70862354) has the molecular formula C27H34N4O3 and a molecular weight of 462.59 g/mol. Its IUPAC name is 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
PubChem CID70862354
Molecular FormulaC27H34N4O3
Molecular Weight462.59 g/mol
Exact Mass462.26
IUPAC Name2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
SMILESCOC1CCCCN1C(=O)c1cn2c(C(=O)NCC(CC(C)C)c3ccccc3)cccc2n1
InChIInChI=1S/C27H34N4O3/c1-19(2)16-21(20-10-5-4-6-11-20)17-28-26(32)23-12-9-13-24-29-22(18-31(23)24)27(33)30-15-8-7-14-25(30)34-3/h4-6,9-13,18-19,21,25H,7-8,14-17H2,1-3H3,(H,28,32)
InChIKeyYXECTNDVBNRRJZ-UHFFFAOYSA-N
XLogP4.49
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.59
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3R)-3-aminopyrrolidine-1-carbonyl]-N-(4-methyl-2-pyridin-3-ylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 70862485
N-(4-methyl-2-phenylpentyl)-2-[2-(2-methylpropylamino)-2-oxoethyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 25266215
ethenoxyethane;2-ethyl-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 143685667
N-(4-methyl-2-phenylpentyl)-2-[2-(morpholin-4-ylamino)-2-oxoethyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 25266905
2-[2-(1-methoxybutan-2-ylamino)-2-oxoethyl]-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide
CID 25266903
2-[2-(aminomethyl)pyrrolidine-1-carbonyl]-N-methylimidazo[1,2-a]pyridine-5-carboxamide
CID 143685983
N-methyl-2-(3-methylazetidine-1-carbonyl)imidazo[1,2-a]pyridine-5-carboxamide;propan-2-ylcyclohexane
CID 143685607
[2-(hydroxymethyl)azepan-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 116636500
2-(2-amino-2-oxoethyl)-N-[4-hydroxy-2-(4-hydroxyphenyl)pentyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 143685759
2-(3-aminopyrrolidine-1-carbonyl)-N-methylimidazo[1,2-a]pyridine-5-carboxamide
CID 143685907
2-[5-[[2-(4-chlorophenyl)-5-fluoro-4-methylpentyl]carbamoyl]imidazo[1,2-a]pyridin-2-yl]-3-phenylpropanoic acid
CID 70862626
(5-methylimidazo[1,2-a]pyridin-2-yl)-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 95313911

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide?
The IUPAC name of 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide (CID 70862354) is 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide.
What is the SMILES notation for 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide?
The canonical SMILES for 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide is COC1CCCCN1C(=O)c1cn2c(C(=O)NCC(CC(C)C)c3ccccc3)cccc2n1.
What is the InChIKey of 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide?
The InChIKey is YXECTNDVBNRRJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N4O3/c1-19(2)16-21(20-10-5-4-6-11-20)17-28-26(32)23-12-9-13-24-29-22(18-31(23)24)27(33)30-15-8-7-14-25(30)34-3/h4-6,9-13,18-19,21,25H,7-8,14-17H2,1-3H3,(H,28,32).
What are the key properties of 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide?
2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide has a molecular weight of 462.59 g/mol, XLogP of 4.49, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypiperidine-1-carbonyl)-N-(4-methyl-2-phenylpentyl)imidazo[1,2-a]pyridine-5-carboxamide is sourced from PubChem (CID 70862354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).