6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide

C13H18ClN3O — CID 106551401

IUPAC6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cncc(Cl)n1)C1CCCCC1
InChIInChI=1S/C13H18ClN3O/c1-9(10-5-3-2-4-6-10)16-13(18)11-7-15-8-12(14)17-11/h7-10H,2-6H2,1H3,(H,16,18)
InChIKeyMTGZWVFTKCVZCW-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.83
Rot. Bonds3

About 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide

6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide (PubChem CID 106551401) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
PubChem CID106551401
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cncc(Cl)n1)C1CCCCC1
InChIInChI=1S/C13H18ClN3O/c1-9(10-5-3-2-4-6-10)16-13(18)11-7-15-8-12(14)17-11/h7-10H,2-6H2,1H3,(H,16,18)
InChIKeyMTGZWVFTKCVZCW-UHFFFAOYSA-N
XLogP2.83
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-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

6-amino-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
CID 114035892
6-chloro-N-(1-cyclohexylethyl)pyridazine-3-carboxamide
CID 55069123
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-6-chloropyrazine-2-carboxamide
CID 103186992
6-chloro-N-(1-cyclopropylbutan-2-yl)pyrazine-2-carboxamide
CID 106551346
N-(1-cyclohexylethyl)-5-hydroxypyridine-3-carboxamide
CID 55256172
2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide
CID 62407259
6-chloro-N-(4-hydroxybutan-2-yl)pyrazine-2-carboxamide
CID 106551541
6-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrazine-2-carboxamide
CID 114035318
5-chloro-N-[(1S)-1-cyclohexylethyl]thiophene-2-carboxamide
CID 159200384
3-(1-cyclohexylethylcarbamoyl)-1,2-oxazole-5-carboxylic acid
CID 107369564
6-chloro-N-(4-hydroxycyclohexyl)pyrazine-2-carboxamide
CID 103336797
6-chloro-N-(1-methylcyclobutyl)pyrazine-2-carboxamide
CID 103187308

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide?
The IUPAC name of 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide (CID 106551401) is 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide is CC(NC(=O)c1cncc(Cl)n1)C1CCCCC1.
What is the InChIKey of 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide?
The InChIKey is MTGZWVFTKCVZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-9(10-5-3-2-4-6-10)16-13(18)11-7-15-8-12(14)17-11/h7-10H,2-6H2,1H3,(H,16,18).
What are the key properties of 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide?
6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide has a molecular weight of 267.76 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 106551401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).