N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide

C19H21ClN4O — CID 20867463

IUPACN-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide
SMILESCCCn1c(CCC(=O)NCc2ccc(Cl)cc2)nc2cccnc21
InChIInChI=1S/C19H21ClN4O/c1-2-12-24-17(23-16-4-3-11-21-19(16)24)9-10-18(25)22-13-14-5-7-15(20)8-6-14/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,25)
InChIKeyHVMYIEZNCCEUIF-UHFFFAOYSA-N
MW356.86 g/mol
LogP3.74
Rot. Bonds7

About N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide

N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide (PubChem CID 20867463) has the molecular formula C19H21ClN4O and a molecular weight of 356.86 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide
PubChem CID20867463
Molecular FormulaC19H21ClN4O
Molecular Weight356.86 g/mol
Exact Mass356.14
IUPAC NameN-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide
SMILESCCCn1c(CCC(=O)NCc2ccc(Cl)cc2)nc2cccnc21
InChIInChI=1S/C19H21ClN4O/c1-2-12-24-17(23-16-4-3-11-21-19(16)24)9-10-18(25)22-13-14-5-7-15(20)8-6-14/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,25)
InChIKeyHVMYIEZNCCEUIF-UHFFFAOYSA-N
XLogP3.74
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.86
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Alpidem
CID 54897
1-(9-(4-chlorophenyl)-8-(2-chlorophenyl)-9H-purin-6-yl)-4-ethylaminopiperidine-4-carboxylic acid amide
CID 10052040
Saripidem
CID 3058746
Nazartinib
CID 72703790
4-(3-((4-Chlorophenyl)methyl)-6-chloroimidazo(4,5-b)pyridin-2-yl)-3,3-dimethylbutanoic acid
CID 3086644
Diphenyl purine derivative 2
CID 72713199
CB 34
CID 6603782
2-(4-Chlorophenyl)imidazo(1,2-a)pyridine
CID 745769
Otenabant hydrochloride
CID 16223963
Diphenyl purine derivative 5
CID 72713196
Diphenyl purine derivative 3
CID 72713197
4-Amino-N-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 11675388

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide (CID 20867463) is N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide is CCCn1c(CCC(=O)NCc2ccc(Cl)cc2)nc2cccnc21.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide?
The InChIKey is HVMYIEZNCCEUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O/c1-2-12-24-17(23-16-4-3-11-21-19(16)24)9-10-18(25)22-13-14-5-7-15(20)8-6-14/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,25).
What are the key properties of N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide?
N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide has a molecular weight of 356.86 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide is sourced from PubChem (CID 20867463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).