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

C15H12FN3O2 — CID 87266262

IUPAC1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2Cc2ccccc2F)cn1
InChIInChI=1S/C15H12FN3O2/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)
InChIKeyTYXJIHQYHQACKU-UHFFFAOYSA-N
MW285.28 g/mol
LogP2.34
Rot. Bonds3

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

1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide (PubChem CID 87266262) has the molecular formula C15H12FN3O2 and a molecular weight of 285.28 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
PubChem CID87266262
Molecular FormulaC15H12FN3O2
Molecular Weight285.28 g/mol
Exact Mass285.09
IUPAC Name1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2Cc2ccccc2F)cn1
InChIInChI=1S/C15H12FN3O2/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)
InChIKeyTYXJIHQYHQACKU-UHFFFAOYSA-N
XLogP2.34
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 52.34
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'}

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Related Compounds

1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
CID 87265967
N-hydroxy-1-(pyridin-4-ylmethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266028
N-hydroxy-1-[(4-methylphenyl)methyl]pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266102
N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266323
1-[(2-fluorophenyl)methyl]indol-6-amine
CID 43308904
1-(6-bromoindol-1-yl)-3-(2-fluorophenyl)propan-2-one
CID 62045340
1-[(2,4-difluorophenyl)methyl]-N-hydroxy-3-[[(2-hydroxy-2-phenylethyl)amino]methyl]pyrrolo[2,3-c]pyridine-5-carboxamide
CID 11690985
1-(2-cyclohexylethyl)-N-hydroxypyrrolo[2,3-c]pyridine-5-carboxamide
CID 11623393
1-[(2-fluorophenyl)methyl]indole-4-carboxylic acid
CID 43316624
N-[(2-fluorophenyl)methyl]-5-methylpyrazine-2-carboxamide
CID 8870889
3-[(4-acetylpiperazin-1-yl)methyl]-1-[(2,4-difluorophenyl)methyl]-N-hydroxypyrrolo[2,3-c]pyridine-5-carboxamide
CID 11704907
1-[(2,4-difluorophenyl)methyl]-3-(ethoxymethyl)-N-hydroxypyrrolo[2,3-c]pyridine-5-carboxamide
CID 10316516

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide (CID 87266262) is 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide is O=C(NO)c1cc2c(ccn2Cc2ccccc2F)cn1.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
The InChIKey is TYXJIHQYHQACKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O2/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-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide?
1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide has a molecular weight of 285.28 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide is sourced from PubChem (CID 87266262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).