2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide

C21H23N5O — CID 56740372

IUPAC2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1c(NCc2ccccn2)cccc1C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C21H23N5O/c1-15-17(8-6-9-18(15)23-13-16-7-2-4-11-22-16)21(27)25-20-14-24-19-10-3-5-12-26(19)20/h2,4,6-9,11,14,23H,3,5,10,12-13H2,1H3,(H,25,27)
InChIKeyXVLWZGLPNRYWCH-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.79
Rot. Bonds5

About 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide

2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide (PubChem CID 56740372) has the molecular formula C21H23N5O and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide.

Molecular Properties

Compound Name2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
PubChem CID56740372
Molecular FormulaC21H23N5O
Molecular Weight361.45 g/mol
Exact Mass361.19
IUPAC Name2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1c(NCc2ccccn2)cccc1C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C21H23N5O/c1-15-17(8-6-9-18(15)23-13-16-7-2-4-11-22-16)21(27)25-20-14-24-19-10-3-5-12-26(19)20/h2,4,6-9,11,14,23H,3,5,10,12-13H2,1H3,(H,25,27)
InChIKeyXVLWZGLPNRYWCH-UHFFFAOYSA-N
XLogP3.79
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenylmethoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
CID 56750651
2-(2-fluoroanilino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)acetamide
CID 56746986
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-2-(1,2,4-triazol-1-yl)benzamide
CID 56759826
2-morpholin-4-yl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
CID 56700772
5-oxo-1-(pyridin-2-ylmethyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide
CID 56703795
6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl-[2-methyl-3-(pyridin-2-ylmethylamino)phenyl]methanone
CID 56884455
N-[(3R,4R)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2-methyl-3-(pyridin-2-ylmethylamino)benzamide
CID 133120656
2-pyridin-2-yl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
CID 56740355
N-[2-oxo-2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylamino)ethyl]benzamide
CID 56753801
N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-methyl-3-(pyridin-2-ylmethylamino)benzamide
CID 95147228
2-(ethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide
CID 56760264
N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]-3-pyridin-2-ylpropanamide
CID 60610430

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide?
The IUPAC name of 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide (CID 56740372) is 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide.
What is the SMILES notation for 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide?
The canonical SMILES for 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide is Cc1c(NCc2ccccn2)cccc1C(=O)Nc1cnc2n1CCCC2.
What is the InChIKey of 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide?
The InChIKey is XVLWZGLPNRYWCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O/c1-15-17(8-6-9-18(15)23-13-16-7-2-4-11-22-16)21(27)25-20-14-24-19-10-3-5-12-26(19)20/h2,4,6-9,11,14,23H,3,5,10,12-13H2,1H3,(H,25,27).
What are the key properties of 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide?
2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide has a molecular weight of 361.45 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(pyridin-2-ylmethylamino)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide is sourced from PubChem (CID 56740372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).