1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one

C13H18N4O2 — CID 112561891

IUPAC1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
SMILESO=C(CNc1nccn(C2CC2)c1=O)N1CCCC1
InChIInChI=1S/C13H18N4O2/c18-11(16-6-1-2-7-16)9-15-12-13(19)17(8-5-14-12)10-3-4-10/h5,8,10H,1-4,6-7,9H2,(H,14,15)
InChIKeyJBOJXCSBUKAUJY-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.61
Rot. Bonds4

About 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one

1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one (PubChem CID 112561891) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
PubChem CID112561891
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
SMILESO=C(CNc1nccn(C2CC2)c1=O)N1CCCC1
InChIInChI=1S/C13H18N4O2/c18-11(16-6-1-2-7-16)9-15-12-13(19)17(8-5-14-12)10-3-4-10/h5,8,10H,1-4,6-7,9H2,(H,14,15)
InChIKeyJBOJXCSBUKAUJY-UHFFFAOYSA-N
XLogP0.61
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-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

Related Compounds

2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N,N-dimethylacetamide
CID 62940892
1-(2-methylpropyl)-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
CID 115765269
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-(2-methylpropyl)acetamide
CID 115917308
1-cyclopropyl-3-(2,2,3,3-tetrafluoropropylamino)pyrazin-2-one
CID 114169567
1-cyclopropyl-3-[(1-hydroxycyclopentyl)methylamino]pyrazin-2-one
CID 65110313
1-cyclopropyl-3-(propylamino)pyrazin-2-one
CID 62938241
2-[[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]methyl]-3-methylbutanoic acid
CID 65226552
1-[[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115433312
3-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]butanoic acid
CID 62938370
1-cyclopropyl-3-[(1-hydroxycyclohexyl)methylamino]pyrazin-2-one
CID 65110579
1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
3-(4-chlorobutylamino)-1-cyclopropylpyrazin-2-one
CID 106845044

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one?
The IUPAC name of 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one (CID 112561891) is 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one?
The canonical SMILES for 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one is O=C(CNc1nccn(C2CC2)c1=O)N1CCCC1.
What is the InChIKey of 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one?
The InChIKey is JBOJXCSBUKAUJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c18-11(16-6-1-2-7-16)9-15-12-13(19)17(8-5-14-12)10-3-4-10/h5,8,10H,1-4,6-7,9H2,(H,14,15).
What are the key properties of 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one?
1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one has a molecular weight of 262.31 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one is sourced from PubChem (CID 112561891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).