1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide

C15H12ClN3O2 — CID 87265967

IUPAC1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2Cc2ccccc2Cl)cn1
InChIInChI=1S/C15H12ClN3O2/c16-12-4-2-1-3-11(12)9-19-6-5-10-8-17-13(7-14(10)19)15(20)18-21/h1-8,21H,9H2,(H,18,20)
InChIKeyTXHWNGXOELIQKH-UHFFFAOYSA-N
MW301.73 g/mol
LogP2.86
Rot. Bonds3

About 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide

1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide (PubChem CID 87265967) has the molecular formula C15H12ClN3O2 and a molecular weight of 301.73 g/mol. Its IUPAC name is 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide.

Molecular Properties

Compound Name1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
PubChem CID87265967
Molecular FormulaC15H12ClN3O2
Molecular Weight301.73 g/mol
Exact Mass301.06
IUPAC Name1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2Cc2ccccc2Cl)cn1
InChIInChI=1S/C15H12ClN3O2/c16-12-4-2-1-3-11(12)9-19-6-5-10-8-17-13(7-14(10)19)15(20)18-21/h1-8,21H,9H2,(H,18,20)
InChIKeyTXHWNGXOELIQKH-UHFFFAOYSA-N
XLogP2.86
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.73
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide 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

1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266262
N-hydroxy-1-(pyridin-4-ylmethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266028
N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266323
N-hydroxy-1-[(2-sulfanylphenyl)methyl]indole-6-carboxamide
CID 90714673
1-[(3-cyanophenyl)methyl]-N-hydroxypyrrolo[2,3-c]pyridine-5-carboxamide
CID 44549519
1-[(2-chlorophenyl)methyl]indole-6-carbothioamide
CID 107917358
1-[(2-chloro-4-fluorophenyl)methyl]-N-hydroxypyrrolo[2,3-b]pyridine-6-carboxamide
CID 87266124
1-benzyl-6-chloropyrrolo[3,2-c]pyridine
CID 166174008
2-[(2-chlorophenyl)methylamino]-N-hydroxypyrimidine-5-carboxamide
CID 57380747
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]acetamide
CID 71931046
N-hydroxy-1-[[4-(hydroxycarbamoyl)phenyl]methyl]indole-6-carboxamide
CID 146035570
2-[(6-chloroindol-1-yl)methyl]benzoic acid
CID 43473250

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The IUPAC name of 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide (CID 87265967) is 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide.
What is the SMILES notation for 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The canonical SMILES for 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide is O=C(NO)c1cc2c(ccn2Cc2ccccc2Cl)cn1.
What is the InChIKey of 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The InChIKey is TXHWNGXOELIQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2/c16-12-4-2-1-3-11(12)9-19-6-5-10-8-17-13(7-14(10)19)15(20)18-21/h1-8,21H,9H2,(H,18,20).
What are the key properties of 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide has a molecular weight of 301.73 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide is sourced from PubChem (CID 87265967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).