1-(2-aminopropyl)pyrazin-2-one

C7H11N3O — CID 130538500

IUPAC1-(2-aminopropyl)pyrazin-2-one
SMILESCC(N)Cn1ccncc1=O
InChIInChI=1S/C7H11N3O/c1-6(8)5-10-3-2-9-4-7(10)11/h2-4,6H,5,8H2,1H3
InChIKeyLLFFQGUEOBCKEP-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.41
Rot. Bonds2

About 1-(2-aminopropyl)pyrazin-2-one

1-(2-aminopropyl)pyrazin-2-one (PubChem CID 130538500) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-(2-aminopropyl)pyrazin-2-one.

Molecular Properties

Compound Name1-(2-aminopropyl)pyrazin-2-one
PubChem CID130538500
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1-(2-aminopropyl)pyrazin-2-one
SMILESCC(N)Cn1ccncc1=O
InChIInChI=1S/C7H11N3O/c1-6(8)5-10-3-2-9-4-7(10)11/h2-4,6H,5,8H2,1H3
InChIKeyLLFFQGUEOBCKEP-UHFFFAOYSA-N
XLogP-0.41
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-aminopropyl)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

1-(3-Amino-1,1,1-trifluoropropan-2-yl)pyrazin-2-one
CID 130538472
1-Propan-2-ylpyrazin-2-one
CID 57640411
1-Butan-2-ylpyrazin-2-one
CID 66924608
6-amino-4-methyl-6H-1,4-diazepin-5-one
CID 91052052
1-(3-Aminopropyl)-2(1h)-pyrazinone
CID 124093153
N-ethyl-1,2-dihydropyrazine-2-carboxamide
CID 141194609
N-butyl-2-(2-oxopyrazin-1-yl)acetamide
CID 121553973
2-Amino-3-(2-oxopyrazin-1-yl)propanamide
CID 130538486
1-[(2R)-2-aminopropyl]pyrazin-2-one
CID 130538502
1-[2-(Methylamino)ethyl]pyrazin-2-one
CID 130538503
1-(2-Aminobutyl)pyrazin-2-one
CID 130538504
1-(2-Amino-3-methylbutyl)pyrazin-2-one
CID 130538505

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopropyl)pyrazin-2-one?
The IUPAC name of 1-(2-aminopropyl)pyrazin-2-one (CID 130538500) is 1-(2-aminopropyl)pyrazin-2-one.
What is the SMILES notation for 1-(2-aminopropyl)pyrazin-2-one?
The canonical SMILES for 1-(2-aminopropyl)pyrazin-2-one is CC(N)Cn1ccncc1=O.
What is the InChIKey of 1-(2-aminopropyl)pyrazin-2-one?
The InChIKey is LLFFQGUEOBCKEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-6(8)5-10-3-2-9-4-7(10)11/h2-4,6H,5,8H2,1H3.
What are the key properties of 1-(2-aminopropyl)pyrazin-2-one?
1-(2-aminopropyl)pyrazin-2-one has a molecular weight of 153.19 g/mol, XLogP of -0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopropyl)pyrazin-2-one is sourced from PubChem (CID 130538500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).