3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide

C15H12BrN3O — CID 8917100

IUPAC3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1cn2ccccc2n1)c1cccc(Br)c1
InChIInChI=1S/C15H12BrN3O/c16-12-5-3-4-11(8-12)15(20)17-9-13-10-19-7-2-1-6-14(19)18-13/h1-8,10H,9H2,(H,17,20)
InChIKeyFNIVNUMKVNCJQH-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.03
Rot. Bonds3

About 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide

3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide (PubChem CID 8917100) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
PubChem CID8917100
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC Name3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1cn2ccccc2n1)c1cccc(Br)c1
InChIInChI=1S/C15H12BrN3O/c16-12-5-3-4-11(8-12)15(20)17-9-13-10-19-7-2-1-6-14(19)18-13/h1-8,10H,9H2,(H,17,20)
InChIKeyFNIVNUMKVNCJQH-UHFFFAOYSA-N
XLogP3.03
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,6-N-bis(imidazo[1,2-a]pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 43063902
3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 4701924
3,4,5-triethoxy-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917080
N-[(2-chlorophenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542001
N-[(3,5-dimethoxyphenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 55576832
3-bromo-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 19330923
1-benzyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrazole-4-carboxamide
CID 9185448
4-chloro-3-(diethylsulfamoyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917124
N-ethyl-3-[[4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzoyl]amino]benzamide
CID 46514327
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 30582719
N-(3-bromophenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18096051
3-(difluoromethoxy)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methoxybenzamide
CID 47040736

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide?
The IUPAC name of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide (CID 8917100) is 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide is O=C(NCc1cn2ccccc2n1)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide?
The InChIKey is FNIVNUMKVNCJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c16-12-5-3-4-11(8-12)15(20)17-9-13-10-19-7-2-1-6-14(19)18-13/h1-8,10H,9H2,(H,17,20).
What are the key properties of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide?
3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide has a molecular weight of 330.19 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 8917100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).