6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide

C10H11FN2O2 — CID 115877668

IUPAC6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide
SMILESO=C(NC1(CO)CC1)c1ccc(F)nc1
InChIInChI=1S/C10H11FN2O2/c11-8-2-1-7(5-12-8)9(15)13-10(6-14)3-4-10/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyOTRGBRRPXWOWFS-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.48
Rot. Bonds3

About 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide

6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide (PubChem CID 115877668) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide
PubChem CID115877668
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide
SMILESO=C(NC1(CO)CC1)c1ccc(F)nc1
InChIInChI=1S/C10H11FN2O2/c11-8-2-1-7(5-12-8)9(15)13-10(6-14)3-4-10/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyOTRGBRRPXWOWFS-UHFFFAOYSA-N
XLogP0.48
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.48
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-[(6-(18F)fluoropyridine-3-carbonyl)amino]acetic acid
CID 175904627
4-tert-butyl-N-[1-(hydroxymethyl)cyclopropyl]benzamide
CID 115764816
3,4-difluoro-N-[1-(hydroxymethyl)cyclobutyl]benzamide
CID 115878348
6-fluoro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
CID 63980448
N-[1-(hydroxymethyl)cyclopropyl]-3,4-dimethylbenzamide
CID 115764896
4-amino-N-[1-(hydroxymethyl)cyclopropyl]-3-methoxybenzamide
CID 89028285
6-fluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 103804726
N-(2-chloroprop-2-enyl)-6-fluoropyridine-3-carboxamide
CID 115668746
N-[1-(hydroxymethyl)cyclohexyl]pyridine-3-carboxamide
CID 62520732
4-butoxy-N-[1-(hydroxymethyl)cyclopropyl]benzamide
CID 115764949
4-fluoro-N-[1-(hydroxymethyl)cyclobutyl]-3-methylbenzamide
CID 115878206
3-amino-4-fluoro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62524113

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide (CID 115877668) is 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide is O=C(NC1(CO)CC1)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide?
The InChIKey is OTRGBRRPXWOWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-8-2-1-7(5-12-8)9(15)13-10(6-14)3-4-10/h1-2,5,14H,3-4,6H2,(H,13,15).
What are the key properties of 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide?
6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide has a molecular weight of 210.21 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[1-(hydroxymethyl)cyclopropyl]pyridine-3-carboxamide is sourced from PubChem (CID 115877668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).