1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one

C12H19N3O2 — CID 113353757

IUPAC1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one
SMILESCCOC(C)CNc1nccn(C2CC2)c1=O
InChIInChI=1S/C12H19N3O2/c1-3-17-9(2)8-14-11-12(16)15(7-6-13-11)10-4-5-10/h6-7,9-10H,3-5,8H2,1-2H3,(H,13,14)
InChIKeyWCKHQFXYHVJMOS-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.42
Rot. Bonds6

About 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one

1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one (PubChem CID 113353757) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one
PubChem CID113353757
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one
SMILESCCOC(C)CNc1nccn(C2CC2)c1=O
InChIInChI=1S/C12H19N3O2/c1-3-17-9(2)8-14-11-12(16)15(7-6-13-11)10-4-5-10/h6-7,9-10H,3-5,8H2,1-2H3,(H,13,14)
InChIKeyWCKHQFXYHVJMOS-UHFFFAOYSA-N
XLogP1.42
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
3-[(4-chloro-2-methylbutyl)amino]-1-cyclopropylpyrazin-2-one
CID 66089237
1-cyclopropyl-3-(propylamino)pyrazin-2-one
CID 62938241
2-[[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]methyl]-3-methylbutanoic acid
CID 65226552
1-cyclopropyl-3-(2-phenylpropylamino)pyrazin-2-one
CID 115917119
1-cyclopropyl-3-(5-methylhexylamino)pyrazin-2-one
CID 115326088
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-(2-methylpropyl)acetamide
CID 115917308
1-cyclopropyl-3-(pentan-2-ylamino)pyrazin-2-one
CID 62940516
1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one
CID 103931036
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N,N-dimethylacetamide
CID 62940892
1-cyclopropyl-3-(3-methylsulfinylbutylamino)pyrazin-2-one
CID 113353769
1-cyclopropyl-3-[(1-methoxycyclobutyl)methylamino]pyrazin-2-one
CID 103989758

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one?
The IUPAC name of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one (CID 113353757) is 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one?
The canonical SMILES for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one is CCOC(C)CNc1nccn(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one?
The InChIKey is WCKHQFXYHVJMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-17-9(2)8-14-11-12(16)15(7-6-13-11)10-4-5-10/h6-7,9-10H,3-5,8H2,1-2H3,(H,13,14).
What are the key properties of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one?
1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one has a molecular weight of 237.30 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrazin-2-one is sourced from PubChem (CID 113353757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).