3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one

C15H25N3O — CID 55155653

IUPAC3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one
SMILESCCC(Nc1nccn(CC)c1=O)C1CCCCC1
InChIInChI=1S/C15H25N3O/c1-3-13(12-8-6-5-7-9-12)17-14-15(19)18(4-2)11-10-16-14/h10-13H,3-9H2,1-2H3,(H,16,17)
InChIKeyONZCVSHAFVMDSV-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.03
Rot. Bonds5

About 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one

3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one (PubChem CID 55155653) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one.

Molecular Properties

Compound Name3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one
PubChem CID55155653
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one
SMILESCCC(Nc1nccn(CC)c1=O)C1CCCCC1
InChIInChI=1S/C15H25N3O/c1-3-13(12-8-6-5-7-9-12)17-14-15(19)18(4-2)11-10-16-14/h10-13H,3-9H2,1-2H3,(H,16,17)
InChIKeyONZCVSHAFVMDSV-UHFFFAOYSA-N
XLogP3.03
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one?
The IUPAC name of 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one (CID 55155653) is 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one.
What is the SMILES notation for 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one?
The canonical SMILES for 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one is CCC(Nc1nccn(CC)c1=O)C1CCCCC1.
What is the InChIKey of 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one?
The InChIKey is ONZCVSHAFVMDSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-13(12-8-6-5-7-9-12)17-14-15(19)18(4-2)11-10-16-14/h10-13H,3-9H2,1-2H3,(H,16,17).
What are the key properties of 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one?
3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one has a molecular weight of 263.38 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclohexylpropylamino)-1-ethylpyrazin-2-one is sourced from PubChem (CID 55155653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).