2-chloro-5-ethylpyridine-3-carboxamide

C8H9ClN2O — CID 123601830

IUPAC2-chloro-5-ethylpyridine-3-carboxamide
SMILESCCc1cnc(Cl)c(C(N)=O)c1
InChIInChI=1S/C8H9ClN2O/c1-2-5-3-6(8(10)12)7(9)11-4-5/h3-4H,2H2,1H3,(H2,10,12)
InChIKeyHCUUTNVACMYCLT-UHFFFAOYSA-N
MW184.63 g/mol
LogP1.40
Rot. Bonds2

About 2-chloro-5-ethylpyridine-3-carboxamide

2-chloro-5-ethylpyridine-3-carboxamide (PubChem CID 123601830) has the molecular formula C8H9ClN2O and a molecular weight of 184.63 g/mol. Its IUPAC name is 2-chloro-5-ethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-5-ethylpyridine-3-carboxamide
PubChem CID123601830
Molecular FormulaC8H9ClN2O
Molecular Weight184.63 g/mol
Exact Mass184.04
IUPAC Name2-chloro-5-ethylpyridine-3-carboxamide
SMILESCCc1cnc(Cl)c(C(N)=O)c1
InChIInChI=1S/C8H9ClN2O/c1-2-5-3-6(8(10)12)7(9)11-4-5/h3-4H,2H2,1H3,(H2,10,12)
InChIKeyHCUUTNVACMYCLT-UHFFFAOYSA-N
XLogP1.40
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.63
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-chloro-5-ethylpyridine-3-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

5-bromo-2-chloropyridine-3-carboxamide
CID 12629794
2-chloro-5-propan-2-ylpyridine-3-carboxamide
CID 91356840
2,3-dichloro-5-ethylpyridine
CID 20678674
2-chloro-5-(2,6-dimethyl-4-pyridinyl)pyridine-3-carboxamide
CID 20509467
ethyl 2-tert-butyl-5-ethylpyridine-3-carboxylate
CID 116533791
ethyl 2-amino-5-ethylpyridine-3-carboxylate
CID 155887465
5-bromo-2-chloropyridine-3-carboxamide;5-bromo-2-chloropyridine-3-carboxylic acid
CID 167685517
2-acetyl-5-ethylpyridine-3-carboxylic acid
CID 19902850
2-bromo-5-butylpyridine-3-carboxamide
CID 173465828
propyl 2-chloro-5-fluoropyridine-3-carboxylate
CID 103881060
2-chloro-5-ethylpyridine-3-carbonitrile
CID 14569539
5-ethyl-2-sulfanylbenzamide
CID 145411190

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-ethylpyridine-3-carboxamide?
The IUPAC name of 2-chloro-5-ethylpyridine-3-carboxamide (CID 123601830) is 2-chloro-5-ethylpyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-5-ethylpyridine-3-carboxamide?
The canonical SMILES for 2-chloro-5-ethylpyridine-3-carboxamide is CCc1cnc(Cl)c(C(N)=O)c1.
What is the InChIKey of 2-chloro-5-ethylpyridine-3-carboxamide?
The InChIKey is HCUUTNVACMYCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O/c1-2-5-3-6(8(10)12)7(9)11-4-5/h3-4H,2H2,1H3,(H2,10,12).
What are the key properties of 2-chloro-5-ethylpyridine-3-carboxamide?
2-chloro-5-ethylpyridine-3-carboxamide has a molecular weight of 184.63 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-ethylpyridine-3-carboxamide is sourced from PubChem (CID 123601830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).