3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one

C13H19N3O — CID 62940870

IUPAC3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one
SMILESO=c1c(NC2CCCCC2)nccn1C1CC1
InChIInChI=1S/C13H19N3O/c17-13-12(15-10-4-2-1-3-5-10)14-8-9-16(13)11-6-7-11/h8-11H,1-7H2,(H,14,15)
InChIKeyIDOYQADENDSDQH-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.32
Rot. Bonds3

About 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one

3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one (PubChem CID 62940870) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one.

Molecular Properties

Compound Name3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one
PubChem CID62940870
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one
SMILESO=c1c(NC2CCCCC2)nccn1C1CC1
InChIInChI=1S/C13H19N3O/c17-13-12(15-10-4-2-1-3-5-10)14-8-9-16(13)11-6-7-11/h8-11H,1-7H2,(H,14,15)
InChIKeyIDOYQADENDSDQH-UHFFFAOYSA-N
XLogP2.32
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclobutylamino)-1-cyclopropylpyrazin-2-one
CID 62927759
1-cyclopropyl-3-(cyclopropylamino)pyrazin-2-one
CID 62939651
1-cyclopropyl-3-[(3,5-dimethylcyclohexyl)amino]pyrazin-2-one
CID 64732893
1-cyclopropyl-3-(thiolan-3-ylamino)pyrazin-2-one
CID 103931022
3-[[2-(chloromethyl)cyclohexyl]amino]-1-cyclopropylpyrazin-2-one
CID 106365711
N-cyclopentyl-1-cyclopropylimidazol-2-amine
CID 106554935
1-cyclopropyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyrazin-2-one
CID 62928982
3-(cycloheptylamino)-1-propan-2-ylpyrazin-2-one
CID 62939319
1-tert-butyl-3-(cycloheptylamino)pyrazin-2-one
CID 62939668
1-tert-butyl-3-(cyclooctylamino)pyrazin-2-one
CID 62938781
1-cyclopropyl-3-[[2-(hydroxymethyl)cyclopentyl]amino]pyrazin-2-one
CID 106361991
N,1-dicyclopropylimidazol-2-amine
CID 106554949

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one?
The IUPAC name of 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one (CID 62940870) is 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one.
What is the SMILES notation for 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one?
The canonical SMILES for 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one is O=c1c(NC2CCCCC2)nccn1C1CC1.
What is the InChIKey of 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one?
The InChIKey is IDOYQADENDSDQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c17-13-12(15-10-4-2-1-3-5-10)14-8-9-16(13)11-6-7-11/h8-11H,1-7H2,(H,14,15).
What are the key properties of 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one?
3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one has a molecular weight of 233.31 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylamino)-1-cyclopropylpyrazin-2-one is sourced from PubChem (CID 62940870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).