2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline

C15H14ClN3 — CID 103768036

IUPAC2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline
SMILESCc1ccc(Cl)c(NCc2cn3ccccc3n2)c1
InChIInChI=1S/C15H14ClN3/c1-11-5-6-13(16)14(8-11)17-9-12-10-19-7-3-2-4-15(19)18-12/h2-8,10,17H,9H2,1H3
InChIKeyYXCGCXSMLBYMLS-UHFFFAOYSA-N
MW271.75 g/mol
LogP3.91
Rot. Bonds3

About 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline

2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline (PubChem CID 103768036) has the molecular formula C15H14ClN3 and a molecular weight of 271.75 g/mol. Its IUPAC name is 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline.

Molecular Properties

Compound Name2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline
PubChem CID103768036
Molecular FormulaC15H14ClN3
Molecular Weight271.75 g/mol
Exact Mass271.09
IUPAC Name2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline
SMILESCc1ccc(Cl)c(NCc2cn3ccccc3n2)c1
InChIInChI=1S/C15H14ClN3/c1-11-5-6-13(16)14(8-11)17-9-12-10-19-7-3-2-4-15(19)18-12/h2-8,10,17H,9H2,1H3
InChIKeyYXCGCXSMLBYMLS-UHFFFAOYSA-N
XLogP3.91
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylaniline
CID 104726088
2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline
CID 107634826
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4,6-dimethylpyridin-2-amine
CID 4702007
4-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 2967719
2-[(2-chloro-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 170746842
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-phenylaniline
CID 43825852
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618
4-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-nitroaniline
CID 60631945
5-bromo-2,4-difluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 102847163
4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylaniline
CID 55118825
N-(imidazo[1,2-a]pyridin-2-ylmethyl)naphthalen-2-amine
CID 43400804
(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
CID 81348736

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline?
The IUPAC name of 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline (CID 103768036) is 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline.
What is the SMILES notation for 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline?
The canonical SMILES for 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline is Cc1ccc(Cl)c(NCc2cn3ccccc3n2)c1.
What is the InChIKey of 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline?
The InChIKey is YXCGCXSMLBYMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3/c1-11-5-6-13(16)14(8-11)17-9-12-10-19-7-3-2-4-15(19)18-12/h2-8,10,17H,9H2,1H3.
What are the key properties of 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline?
2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline has a molecular weight of 271.75 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline is sourced from PubChem (CID 103768036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).