N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide

C19H20ClN3O — CID 110672012

IUPACN-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide
SMILESCc1cccc(CCC(=O)NCCc2cn3cc(Cl)ccc3n2)c1
InChIInChI=1S/C19H20ClN3O/c1-14-3-2-4-15(11-14)5-8-19(24)21-10-9-17-13-23-12-16(20)6-7-18(23)22-17/h2-4,6-7,11-13H,5,8-10H2,1H3,(H,21,24)
InChIKeyWEKJJYVXONITKC-UHFFFAOYSA-N
MW341.84 g/mol
LogP3.59
Rot. Bonds6

About N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide

N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide (PubChem CID 110672012) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide
PubChem CID110672012
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC NameN-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide
SMILESCc1cccc(CCC(=O)NCCc2cn3cc(Cl)ccc3n2)c1
InChIInChI=1S/C19H20ClN3O/c1-14-3-2-4-15(11-14)5-8-19(24)21-10-9-17-13-23-12-16(20)6-7-18(23)22-17/h2-4,6-7,11-13H,5,8-10H2,1H3,(H,21,24)
InChIKeyWEKJJYVXONITKC-UHFFFAOYSA-N
XLogP3.59
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide?
The IUPAC name of N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide (CID 110672012) is N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide.
What is the SMILES notation for N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide?
The canonical SMILES for N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide is Cc1cccc(CCC(=O)NCCc2cn3cc(Cl)ccc3n2)c1.
What is the InChIKey of N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide?
The InChIKey is WEKJJYVXONITKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c1-14-3-2-4-15(11-14)5-8-19(24)21-10-9-17-13-23-12-16(20)6-7-18(23)22-17/h2-4,6-7,11-13H,5,8-10H2,1H3,(H,21,24).
What are the key properties of N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide?
N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide has a molecular weight of 341.84 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 110672012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).