N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

C21H18ClN3 — CID 808678

IUPACN-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc2nc(-c3ccc(Cl)cc3)c(NCc3ccccc3)n12
InChIInChI=1S/C21H18ClN3/c1-15-6-5-9-19-24-20(17-10-12-18(22)13-11-17)21(25(15)19)23-14-16-7-3-2-4-8-16/h2-13,23H,14H2,1H3
InChIKeyTULUOPCCFZDHTD-UHFFFAOYSA-N
MW347.85 g/mol
LogP5.58
Rot. Bonds4

About N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 808678) has the molecular formula C21H18ClN3 and a molecular weight of 347.85 g/mol. Its IUPAC name is N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID808678
Molecular FormulaC21H18ClN3
Molecular Weight347.85 g/mol
Exact Mass347.12
IUPAC NameN-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc2nc(-c3ccc(Cl)cc3)c(NCc3ccccc3)n12
InChIInChI=1S/C21H18ClN3/c1-15-6-5-9-19-24-20(17-10-12-18(22)13-11-17)21(25(15)19)23-14-16-7-3-2-4-8-16/h2-13,23H,14H2,1H3
InChIKeyTULUOPCCFZDHTD-UHFFFAOYSA-N
XLogP5.58
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.85
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-5-methyl-N-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 7338705
N-benzyl-5-methyl-2-propylimidazo[1,2-a]pyridin-3-amine
CID 808707
N-[(3-chlorophenyl)methyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 59402651
N-benzyl-2-[4-(3-chlorophenyl)phenyl]imidazo[1,2-a]pyridin-3-amine
CID 42601069
N-benzyl-5,7-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 42740245
N-benzyl-5-methyl-2-[(E)-1-phenylprop-1-en-2-yl]imidazo[1,2-a]pyridin-3-amine
CID 42738351
5-methyl-N,2-bis(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 3515709
2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 23792325
N-benzyl-2-[2-(2-methoxyphenyl)ethenyl]-5-methylimidazo[1,2-a]pyridin-3-amine
CID 4271216
1-(4-chlorophenyl)-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methanimine
CID 23994402
5-methyl-2-(4-methylsulfonylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 167713578
N-benzyl-2-pyridin-4-ylimidazo[1,2-a]pyridin-3-amine
CID 70676789

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (CID 808678) is N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is Cc1cccc2nc(-c3ccc(Cl)cc3)c(NCc3ccccc3)n12.
What is the InChIKey of N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is TULUOPCCFZDHTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3/c1-15-6-5-9-19-24-20(17-10-12-18(22)13-11-17)21(25(15)19)23-14-16-7-3-2-4-8-16/h2-13,23H,14H2,1H3.
What are the key properties of N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 347.85 g/mol, XLogP of 5.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(4-chlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 808678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).