2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline

C15H13Cl2N3 — CID 107634826

IUPAC2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline
SMILESCc1ccc(Cl)c(NCc2cn3cc(Cl)ccc3n2)c1
InChIInChI=1S/C15H13Cl2N3/c1-10-2-4-13(17)14(6-10)18-7-12-9-20-8-11(16)3-5-15(20)19-12/h2-6,8-9,18H,7H2,1H3
InChIKeyAFATVLJFZTVDMY-UHFFFAOYSA-N
MW306.20 g/mol
LogP4.56
Rot. Bonds3

About 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline

2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline (PubChem CID 107634826) has the molecular formula C15H13Cl2N3 and a molecular weight of 306.20 g/mol. Its IUPAC name is 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline.

Molecular Properties

Compound Name2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline
PubChem CID107634826
Molecular FormulaC15H13Cl2N3
Molecular Weight306.20 g/mol
Exact Mass305.05
IUPAC Name2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline
SMILESCc1ccc(Cl)c(NCc2cn3cc(Cl)ccc3n2)c1
InChIInChI=1S/C15H13Cl2N3/c1-10-2-4-13(17)14(6-10)18-7-12-9-20-8-11(16)3-5-15(20)19-12/h2-6,8-9,18H,7H2,1H3
InChIKeyAFATVLJFZTVDMY-UHFFFAOYSA-N
XLogP4.56
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.20
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-methylaniline
CID 103768036
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2,5-difluoroaniline
CID 78914191
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-propan-2-ylaniline
CID 78914568
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
CID 78912513
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-methoxyaniline
CID 78912735
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-iodoaniline
CID 78912750
1-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 82723556
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
CID 115625717
2-chloro-5-methyl-N-[(5-methyl-2-pyridinyl)methyl]aniline
CID 103880797
2,5-dichloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylaniline
CID 104726088
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methoxy-2-methylpropan-2-amine
CID 113231286
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutanamide
CID 47150050

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline?
The IUPAC name of 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline (CID 107634826) is 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline.
What is the SMILES notation for 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline?
The canonical SMILES for 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline is Cc1ccc(Cl)c(NCc2cn3cc(Cl)ccc3n2)c1.
What is the InChIKey of 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline?
The InChIKey is AFATVLJFZTVDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3/c1-10-2-4-13(17)14(6-10)18-7-12-9-20-8-11(16)3-5-15(20)19-12/h2-6,8-9,18H,7H2,1H3.
What are the key properties of 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline?
2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline has a molecular weight of 306.20 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline is sourced from PubChem (CID 107634826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).