N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide

C18H18ClN3O — CID 135020833

IUPACN-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide
SMILESCCCC(=O)N(C)c1c(-c2ccc(Cl)cc2)nc2ccccn12
InChIInChI=1S/C18H18ClN3O/c1-3-6-16(23)21(2)18-17(13-8-10-14(19)11-9-13)20-15-7-4-5-12-22(15)18/h4-5,7-12H,3,6H2,1-2H3
InChIKeyFRUJGAOOMDCJIX-UHFFFAOYSA-N
MW327.82 g/mol
LogP4.42
Rot. Bonds4

About N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide

N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide (PubChem CID 135020833) has the molecular formula C18H18ClN3O and a molecular weight of 327.82 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide
PubChem CID135020833
Molecular FormulaC18H18ClN3O
Molecular Weight327.82 g/mol
Exact Mass327.11
IUPAC NameN-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide
SMILESCCCC(=O)N(C)c1c(-c2ccc(Cl)cc2)nc2ccccn12
InChIInChI=1S/C18H18ClN3O/c1-3-6-16(23)21(2)18-17(13-8-10-14(19)11-9-13)20-15-7-4-5-12-22(15)18/h4-5,7-12H,3,6H2,1-2H3
InChIKeyFRUJGAOOMDCJIX-UHFFFAOYSA-N
XLogP4.42
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.82
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]butanoic acid
CID 18671711
4-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]butanoic acid
CID 70025253
1-[[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-N,N-dimethyl-1,2,4-triazole-3-carboxamide
CID 67029035
N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-4-ethylbenzamide
CID 42881568
[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 2757796
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(2-methylphenyl)propanamide
CID 53036610
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[(3-methoxyphenyl)methyl]propanamide
CID 53118599
2-(4-chlorophenoxy)-N-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
CID 18279274
1-[[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-4-(dimethylamino)pyrimidin-2-one
CID 67028507
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[(3-fluorophenyl)methyl]propanamide
CID 53036640
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[(4-fluorophenyl)methyl]propanamide
CID 53036623
3-(4-bromophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridine
CID 155255091

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide?
The IUPAC name of N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide (CID 135020833) is N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide?
The canonical SMILES for N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide is CCCC(=O)N(C)c1c(-c2ccc(Cl)cc2)nc2ccccn12.
What is the InChIKey of N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide?
The InChIKey is FRUJGAOOMDCJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O/c1-3-6-16(23)21(2)18-17(13-8-10-14(19)11-9-13)20-15-7-4-5-12-22(15)18/h4-5,7-12H,3,6H2,1-2H3.
What are the key properties of N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide?
N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide has a molecular weight of 327.82 g/mol, XLogP of 4.42, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-methylbutanamide is sourced from PubChem (CID 135020833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).