1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one

C13H19N3O — CID 103931036

IUPAC1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one
SMILESCCC1(CNc2nccn(C3CC3)c2=O)CC1
InChIInChI=1S/C13H19N3O/c1-2-13(5-6-13)9-15-11-12(17)16(8-7-14-11)10-3-4-10/h7-8,10H,2-6,9H2,1H3,(H,14,15)
InChIKeyKYULWUHDJGXGDI-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.18
Rot. Bonds5

About 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one

1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one (PubChem CID 103931036) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one
PubChem CID103931036
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one
SMILESCCC1(CNc2nccn(C3CC3)c2=O)CC1
InChIInChI=1S/C13H19N3O/c1-2-13(5-6-13)9-15-11-12(17)16(8-7-14-11)10-3-4-10/h7-8,10H,2-6,9H2,1H3,(H,14,15)
InChIKeyKYULWUHDJGXGDI-UHFFFAOYSA-N
XLogP2.18
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-3-[(1-methoxycyclobutyl)methylamino]pyrazin-2-one
CID 103989758
1-cyclopropyl-3-(propylamino)pyrazin-2-one
CID 62938241
1-cyclopropyl-3-[(1-hydroxycyclopentyl)methylamino]pyrazin-2-one
CID 65110313
1-cyclopropyl-3-[(1-hydroxy-4-methylcyclohexyl)methylamino]pyrazin-2-one
CID 65118452
1-cyclopropyl-3-[(1-hydroxycyclohexyl)methylamino]pyrazin-2-one
CID 65110579
1-[[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115433312
1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
4-[[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]methyl]oxane-4-carboxylic acid
CID 115438721
3-[(1-chloro-2-methylbutan-2-yl)amino]-1-cyclopropylpyrazin-2-one
CID 65028809
3-[[1-(2-aminoethyl)cyclopropyl]methylamino]-1-methylpyrazin-2-one
CID 114759174
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide
CID 103931001
1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one
CID 113353757

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one?
The IUPAC name of 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one (CID 103931036) is 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one?
The canonical SMILES for 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one is CCC1(CNc2nccn(C3CC3)c2=O)CC1.
What is the InChIKey of 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one?
The InChIKey is KYULWUHDJGXGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-13(5-6-13)9-15-11-12(17)16(8-7-14-11)10-3-4-10/h7-8,10H,2-6,9H2,1H3,(H,14,15).
What are the key properties of 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one?
1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one has a molecular weight of 233.31 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one is sourced from PubChem (CID 103931036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).