1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one

C14H21N5O2 — CID 62938883

IUPAC1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one
SMILESCn1ccnc(N2CCCC2C(=O)N2CCNCC2)c1=O
InChIInChI=1S/C14H21N5O2/c1-17-8-6-16-12(14(17)21)19-7-2-3-11(19)13(20)18-9-4-15-5-10-18/h6,8,11,15H,2-5,7,9-10H2,1H3
InChIKeyVOAYJZWKDNRPGC-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.82
Rot. Bonds2

About 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one

1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one (PubChem CID 62938883) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one.

Molecular Properties

Compound Name1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one
PubChem CID62938883
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one
SMILESCn1ccnc(N2CCCC2C(=O)N2CCNCC2)c1=O
InChIInChI=1S/C14H21N5O2/c1-17-8-6-16-12(14(17)21)19-7-2-3-11(19)13(20)18-9-4-15-5-10-18/h6,8,11,15H,2-5,7,9-10H2,1H3
InChIKeyVOAYJZWKDNRPGC-UHFFFAOYSA-N
XLogP-0.82
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]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

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one?
The IUPAC name of 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one (CID 62938883) is 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one.
What is the SMILES notation for 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one?
The canonical SMILES for 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one is Cn1ccnc(N2CCCC2C(=O)N2CCNCC2)c1=O.
What is the InChIKey of 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one?
The InChIKey is VOAYJZWKDNRPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-17-8-6-16-12(14(17)21)19-7-2-3-11(19)13(20)18-9-4-15-5-10-18/h6,8,11,15H,2-5,7,9-10H2,1H3.
What are the key properties of 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one?
1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one has a molecular weight of 291.35 g/mol, XLogP of -0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pyrazin-2-one is sourced from PubChem (CID 62938883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).