3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide

C16H16N4O — CID 43767579

IUPAC3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide
SMILESCc1nc2ccccn2c1CNc1cccc(C(N)=O)c1
InChIInChI=1S/C16H16N4O/c1-11-14(20-8-3-2-7-15(20)19-11)10-18-13-6-4-5-12(9-13)16(17)21/h2-9,18H,10H2,1H3,(H2,17,21)
InChIKeyQITBPUMZTVWMBJ-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.35
Rot. Bonds4

About 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide

3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide (PubChem CID 43767579) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide.

Molecular Properties

Compound Name3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide
PubChem CID43767579
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide
SMILESCc1nc2ccccn2c1CNc1cccc(C(N)=O)c1
InChIInChI=1S/C16H16N4O/c1-11-14(20-8-3-2-7-15(20)19-11)10-18-13-6-4-5-12(9-13)16(17)21/h2-9,18H,10H2,1H3,(H2,17,21)
InChIKeyQITBPUMZTVWMBJ-UHFFFAOYSA-N
XLogP2.35
TPSA72.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methylimidazo[1,2-a]pyridin-3-yl)methylurea
CID 139728346
N-(3-acetylphenyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84569585
5-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyridin-3-amine
CID 103823924
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydro-1H-inden-5-amine
CID 43760891
4-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]butanamide
CID 60863042
2-ethyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43764503
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-4-propan-2-ylaniline
CID 43760553
3-fluoro-4-methoxy-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43775876
6-bromo-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyridin-3-amine
CID 103934296
2,4,5-trichloro-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43759055
3-[(2-hydroxyphenyl)methylamino]benzamide
CID 28650539
2-fluoro-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43763308

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide?
The IUPAC name of 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide (CID 43767579) is 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide.
What is the SMILES notation for 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide?
The canonical SMILES for 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide is Cc1nc2ccccn2c1CNc1cccc(C(N)=O)c1.
What is the InChIKey of 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide?
The InChIKey is QITBPUMZTVWMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-11-14(20-8-3-2-7-15(20)19-11)10-18-13-6-4-5-12(9-13)16(17)21/h2-9,18H,10H2,1H3,(H2,17,21).
What are the key properties of 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide?
3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide has a molecular weight of 280.33 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]benzamide is sourced from PubChem (CID 43767579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).