N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide

C15H11Cl3N4O — CID 130447855

IUPACN-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCc1nc2nc(Cl)ccc2[nH]1
InChIInChI=1S/C15H11Cl3N4O/c16-9-2-1-8(10(17)6-9)5-14(23)19-7-13-20-11-3-4-12(18)21-15(11)22-13/h1-4,6H,5,7H2,(H,19,23)(H,20,21,22)
InChIKeyZBOHCHCLWLJISF-UHFFFAOYSA-N
MW369.64 g/mol
LogP3.78
Rot. Bonds4

About N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide

N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide (PubChem CID 130447855) has the molecular formula C15H11Cl3N4O and a molecular weight of 369.64 g/mol. Its IUPAC name is N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide
PubChem CID130447855
Molecular FormulaC15H11Cl3N4O
Molecular Weight369.64 g/mol
Exact Mass368.00
IUPAC NameN-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCc1nc2nc(Cl)ccc2[nH]1
InChIInChI=1S/C15H11Cl3N4O/c16-9-2-1-8(10(17)6-9)5-14(23)19-7-13-20-11-3-4-12(18)21-15(11)22-13/h1-4,6H,5,7H2,(H,19,23)(H,20,21,22)
InChIKeyZBOHCHCLWLJISF-UHFFFAOYSA-N
XLogP3.78
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.64
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(2,4-dichlorophenyl)-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 54884808
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021
2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 63311270
1-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-4-[(2,4-dichlorophenyl)methyl]-3-(2-hydroxyethyl)imidazolidin-2-one
CID 142507742
(2S)-2-amino-N-(1H-benzimidazol-2-ylmethyl)-3-(2,4-dichlorophenyl)propanamide
CID 130448110
2-amino-N-(1H-benzimidazol-2-ylmethyl)-3-(2,4-dichlorophenyl)propanamide
CID 118878691
(2S)-N-(1H-benzimidazol-2-ylmethyl)-3-(2,4-dichlorophenyl)-2-methylpropanamide
CID 130467580
N-[(2,4-dichlorophenyl)methyl]-2-iodoacetamide
CID 70030657
2-(2,4-dichlorophenyl)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]acetamide
CID 7676714
N-(1H-benzimidazol-2-yl)-2-(2,4-dichlorophenyl)acetamide
CID 2678955
(2S)-3-[[2-(2,4-dichlorophenyl)acetyl]amino]-2-hydroxypropanoic acid
CID 114006523
N-[2-(4-chlorophenyl)ethyl]-2-(2,4-dichlorophenyl)acetamide
CID 9217667

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide?
The IUPAC name of N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide (CID 130447855) is N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1Cl)NCc1nc2nc(Cl)ccc2[nH]1.
What is the InChIKey of N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide?
The InChIKey is ZBOHCHCLWLJISF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl3N4O/c16-9-2-1-8(10(17)6-9)5-14(23)19-7-13-20-11-3-4-12(18)21-15(11)22-13/h1-4,6H,5,7H2,(H,19,23)(H,20,21,22).
What are the key properties of N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide?
N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide has a molecular weight of 369.64 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]-2-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 130447855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).