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

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CID 5309446
Clemizole
CID 2782
Chlormidazole
CID 71821
Saripidem
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2-(4-Chlorophenyl)imidazo(1,2-a)pyridine
CID 745769
1-(4-Chlorobenzyl)-1H-benzimidazole
CID 853038
2-((4-Chlorophenyl)methyl)-1H-benzimidazole
CID 225500
N-(2-chlorophenyl)-5-phenylimidazo[1,5-a]pyrazin-8-amine
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Eapb-0203
CID 24779760
1-(4-Chlorophenylmethyl)-2-aminobenzimidazole
CID 743900
6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538792
7-butyl-6-(4-chlorophenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538794

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).