N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide

C16H26N4O — CID 107375780

IUPACN-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NC2CCC(C)CC2C)cn1
InChIInChI=1S/C16H26N4O/c1-4-7-17-15-10-18-14(9-19-15)16(21)20-13-6-5-11(2)8-12(13)3/h9-13H,4-8H2,1-3H3,(H,17,19)(H,20,21)
InChIKeyHZAZQXDOMJGBSH-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.85
Rot. Bonds5

About N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide

N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide (PubChem CID 107375780) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide
PubChem CID107375780
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NC2CCC(C)CC2C)cn1
InChIInChI=1S/C16H26N4O/c1-4-7-17-15-10-18-14(9-19-15)16(21)20-13-6-5-11(2)8-12(13)3/h9-13H,4-8H2,1-3H3,(H,17,19)(H,20,21)
InChIKeyHZAZQXDOMJGBSH-UHFFFAOYSA-N
XLogP2.85
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,4-dimethylcyclohexyl)-5-(propylamino)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

N-(2,4-dimethylcyclohexyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107378326
N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271032
N-[(4-methylcyclohexyl)methyl]-5-(propylamino)pyrazine-2-carboxamide
CID 107375618
N-(2,2-dimethylcyclopentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376214
6-[(2,4-dimethylcyclohexyl)carbamoyl]pyridine-3-carboxylic acid
CID 63997179
N-(2,4-dimethylcyclohexyl)-5-(methylamino)pyridine-2-carboxamide
CID 104641444
5-(ethylamino)-N-(2-propylcyclopropyl)pyrazine-2-carboxamide
CID 114112346
N-(2-cyclohexylethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374667
N-(3-cyclopentylpropyl)-5-(propylamino)pyrazine-2-carboxamide
CID 106015585
N-(2,4-dimethylcyclohexyl)-5-(3-hydroxyprop-1-ynyl)pyridine-2-carboxamide
CID 63999206
N-(2-methylbutan-2-yl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374127
N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109273887

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide (CID 107375780) is N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide is CCCNc1cnc(C(=O)NC2CCC(C)CC2C)cn1.
What is the InChIKey of N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide?
The InChIKey is HZAZQXDOMJGBSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-4-7-17-15-10-18-14(9-19-15)16(21)20-13-6-5-11(2)8-12(13)3/h9-13H,4-8H2,1-3H3,(H,17,19)(H,20,21).
What are the key properties of N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide?
N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107375780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).