3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide

C10H13FN2O3 — CID 110474765

IUPAC3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCOCCO)c1ncccc1F
InChIInChI=1S/C10H13FN2O3/c11-8-2-1-3-12-9(8)10(15)13-4-6-16-7-5-14/h1-3,14H,4-7H2,(H,13,15)
InChIKeyJBPBDHOPPBGGJO-UHFFFAOYSA-N
MW228.22 g/mol
LogP-0.04
Rot. Bonds6

About 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide

3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide (PubChem CID 110474765) has the molecular formula C10H13FN2O3 and a molecular weight of 228.22 g/mol. Its IUPAC name is 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide
PubChem CID110474765
Molecular FormulaC10H13FN2O3
Molecular Weight228.22 g/mol
Exact Mass228.09
IUPAC Name3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCOCCO)c1ncccc1F
InChIInChI=1S/C10H13FN2O3/c11-8-2-1-3-12-9(8)10(15)13-4-6-16-7-5-14/h1-3,14H,4-7H2,(H,13,15)
InChIKeyJBPBDHOPPBGGJO-UHFFFAOYSA-N
XLogP-0.04
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.22
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 110474737
N-[3-(dimethylamino)propyl]-3-fluoropyridine-2-carboxamide
CID 110474763
3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzamide
CID 60654478
2,6-difluoro-N-[2-(2-hydroxyethoxy)ethyl]-3-methylbenzamide
CID 82816311
3-(3-cyano-2-pyridinyl)-5-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzamide
CID 169415366
2-(2-ethoxyethylcarbamoyl)pyridine-3-carboxylic acid
CID 63615728
N-[2-(2-amino-2-oxoethoxy)ethyl]-3-hydroxypyridine-2-carboxamide
CID 103819834
3-fluoro-N-[2-(1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
CID 110474816
4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxybenzamide
CID 81284195
3-amino-2,6-difluoro-N-[2-(2-hydroxyethoxy)ethyl]benzamide
CID 79773667
2-[2-[(3-bromopyridine-2-carbonyl)amino]ethoxy]acetic acid
CID 107517184
N-(2-butoxyethyl)-3-(4-hydroxybut-1-ynyl)pyridine-2-carboxamide
CID 107522126

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide (CID 110474765) is 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide is O=C(NCCOCCO)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide?
The InChIKey is JBPBDHOPPBGGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3/c11-8-2-1-3-12-9(8)10(15)13-4-6-16-7-5-14/h1-3,14H,4-7H2,(H,13,15).
What are the key properties of 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide?
3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide has a molecular weight of 228.22 g/mol, XLogP of -0.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 110474765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).