(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide

C20H23N5O — CID 95622313

IUPAC(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide
SMILESCc1cn2cc(NC(=O)[C@@H]3CCCCN3Cc3cccnc3)ccc2n1
InChIInChI=1S/C20H23N5O/c1-15-12-25-14-17(7-8-19(25)22-15)23-20(26)18-6-2-3-10-24(18)13-16-5-4-9-21-11-16/h4-5,7-9,11-12,14,18H,2-3,6,10,13H2,1H3,(H,23,26)/t18-/m0/s1
InChIKeyXAGXLZBYTUZFED-SFHVURJKSA-N
MW349.44 g/mol
LogP3.03
Rot. Bonds4

About (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide

(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide (PubChem CID 95622313) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide
PubChem CID95622313
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide
SMILESCc1cn2cc(NC(=O)[C@@H]3CCCCN3Cc3cccnc3)ccc2n1
InChIInChI=1S/C20H23N5O/c1-15-12-25-14-17(7-8-19(25)22-15)23-20(26)18-6-2-3-10-24(18)13-16-5-4-9-21-11-16/h4-5,7-9,11-12,14,18H,2-3,6,10,13H2,1H3,(H,23,26)/t18-/m0/s1
InChIKeyXAGXLZBYTUZFED-SFHVURJKSA-N
XLogP3.03
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[4-(3-fluorophenyl)phenyl]-1-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 42518874
(2S)-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide
CID 96516993
(2R)-N-(3-pyrazol-1-ylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 42292661
1-[(4-fluorophenyl)methyl]-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 136512014
(2S)-1-(pyridin-3-ylmethyl)-N-[2-(pyrimidin-2-ylamino)ethyl]piperidine-2-carboxamide
CID 95619721
N-[3-(2-methylimidazol-1-yl)propyl]-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide
CID 56786115
1-[(2-ethylsulfanylpyrimidin-5-yl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidine-2-carboxamide
CID 45208265
1-[1-(pyridin-3-ylmethyl)azepan-2-yl]propan-2-one
CID 79560623
(2R)-1-[[5-(methoxymethyl)furan-2-yl]methyl]-N-(4-pyridin-3-yloxyphenyl)piperidine-2-carboxamide
CID 42522707
N'-hydroxy-1-(pyridin-3-ylmethyl)piperidine-2-carboximidamide
CID 77041710
(2R)-N-[3-(methoxymethyl)phenyl]-1-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 95308116
1-(pyridin-3-ylmethyl)-N-[1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine-2-carboxamide
CID 139001876

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide (CID 95622313) is (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide is Cc1cn2cc(NC(=O)[C@@H]3CCCCN3Cc3cccnc3)ccc2n1.
What is the InChIKey of (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide?
The InChIKey is XAGXLZBYTUZFED-SFHVURJKSA-N. The full InChI is InChI=1S/C20H23N5O/c1-15-12-25-14-17(7-8-19(25)22-15)23-20(26)18-6-2-3-10-24(18)13-16-5-4-9-21-11-16/h4-5,7-9,11-12,14,18H,2-3,6,10,13H2,1H3,(H,23,26)/t18-/m0/s1.
What are the key properties of (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide?
(2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide has a molecular weight of 349.44 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)-1-(pyridin-3-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 95622313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).