2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide

C14H13ClN2O3 — CID 111113147

IUPAC2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(OCCO)cc1)c1cccnc1Cl
InChIInChI=1S/C14H13ClN2O3/c15-13-12(2-1-7-16-13)14(19)17-10-3-5-11(6-4-10)20-9-8-18/h1-7,18H,8-9H2,(H,17,19)
InChIKeyGAFNIHHPGAYCQA-UHFFFAOYSA-N
MW292.72 g/mol
LogP2.36
Rot. Bonds5

About 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide

2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide (PubChem CID 111113147) has the molecular formula C14H13ClN2O3 and a molecular weight of 292.72 g/mol. Its IUPAC name is 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide
PubChem CID111113147
Molecular FormulaC14H13ClN2O3
Molecular Weight292.72 g/mol
Exact Mass292.06
IUPAC Name2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(OCCO)cc1)c1cccnc1Cl
InChIInChI=1S/C14H13ClN2O3/c15-13-12(2-1-7-16-13)14(19)17-10-3-5-11(6-4-10)20-9-8-18/h1-7,18H,8-9H2,(H,17,19)
InChIKeyGAFNIHHPGAYCQA-UHFFFAOYSA-N
XLogP2.36
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.72
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-bromophenyl)-2-chloropyridine-3-carboxamide
CID 4604195
N-[4-(2-hydroxyethoxy)phenyl]-2-methylbenzamide
CID 111116241
2-chloro-N-[3-(2-methoxyethoxy)phenyl]pyridine-3-carboxamide
CID 61041501
2,4-dichloro-N-[4-(2-hydroxyethoxy)phenyl]benzamide
CID 111116219
2-chloro-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 4063614
2,4-dichloro-5-fluoro-N-[4-(2-hydroxyethoxy)phenyl]benzamide
CID 111116203
2-chloro-N-[3-(hydroxymethyl)phenyl]pyridine-3-carboxamide
CID 51891437
N-[4-(acetylcarbamothioylamino)phenyl]-2-chloropyridine-3-carboxamide
CID 930095
2-chloro-N-[[4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methylideneamino]pyridine-3-carboxamide
CID 4997458
N-[4-(2-hydroxyethoxy)phenyl]-6-methylpyridine-3-carboxamide
CID 111113144
2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
CID 61041355
2-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-3-carboxamide
CID 60637342

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide (CID 111113147) is 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide is O=C(Nc1ccc(OCCO)cc1)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide?
The InChIKey is GAFNIHHPGAYCQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3/c15-13-12(2-1-7-16-13)14(19)17-10-3-5-11(6-4-10)20-9-8-18/h1-7,18H,8-9H2,(H,17,19).
What are the key properties of 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide?
2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide has a molecular weight of 292.72 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 111113147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).