azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone

C16H12Cl2N4O — CID 162659990

IUPACazetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone
SMILESO=C(c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1)N1CCC1
InChIInChI=1S/C16H12Cl2N4O/c17-11-5-4-10(9-12(11)18)22-14-13(3-1-6-19-14)20-15(22)16(23)21-7-2-8-21/h1,3-6,9H,2,7-8H2
InChIKeyBYLKEODIXROZCO-UHFFFAOYSA-N
MW347.21 g/mol
LogP3.57
Rot. Bonds2

About azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone

azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone (PubChem CID 162659990) has the molecular formula C16H12Cl2N4O and a molecular weight of 347.21 g/mol. Its IUPAC name is azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone.

Molecular Properties

Compound Nameazetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone
PubChem CID162659990
Molecular FormulaC16H12Cl2N4O
Molecular Weight347.21 g/mol
Exact Mass346.04
IUPAC Nameazetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone
SMILESO=C(c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1)N1CCC1
InChIInChI=1S/C16H12Cl2N4O/c17-11-5-4-10(9-12(11)18)22-14-13(3-1-6-19-14)20-15(22)16(23)21-7-2-8-21/h1,3-6,9H,2,7-8H2
InChIKeyBYLKEODIXROZCO-UHFFFAOYSA-N
XLogP3.57
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.21
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone 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

Imidazo[1,2-a]pyridine,2-[[4-(3,4-dichlorophenyl)-1-piperazinyl]methyl]-
CID 11516033
N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 118710459
7,8-Dichloropyrido[1,2-a]benzimidazole
CID 915136
2-(4-Chlorophenyl)-N,N-dipropyl-3H-imidazo[4,5-b]pyridine-3-acetamide
CID 14390227
2-(4-Chlorophenyl)-N,N-dibutyl-3H-imidazo[4,5-b]pyridine-3-acetamide
CID 14390306
2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N-methyl-N-propylacetamide
CID 14390388
N-(4-chlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024165
N-(3,4-dichlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024167
N-Cyclopropyl-3-(3,4-dichlorophenyl)-3H-imidazo[4,5-b]pyridine-2-carboxamide
CID 90343287
1-amino-N-(4-chlorophenyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 168284907
3H-Imidazo(4,5-b)pyridine, 3-(4-chlorophenyl)-
CID 3076804
1-allyl-5,6-dichloro-2-(2-chloro-3-pyridinyl)-1H-1,3-benzimidazole
CID 1472023

Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone?
The IUPAC name of azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone (CID 162659990) is azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone.
What is the SMILES notation for azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone?
The canonical SMILES for azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone is O=C(c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1)N1CCC1.
What is the InChIKey of azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone?
The InChIKey is BYLKEODIXROZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N4O/c17-11-5-4-10(9-12(11)18)22-14-13(3-1-6-19-14)20-15(22)16(23)21-7-2-8-21/h1,3-6,9H,2,7-8H2.
What are the key properties of azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone?
azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone has a molecular weight of 347.21 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl-[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]methanone is sourced from PubChem (CID 162659990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).