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

C11H18N4O — CID 63267799

IUPAC1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one
SMILESCNCC1CCN(c2nccn(C)c2=O)C1
InChIInChI=1S/C11H18N4O/c1-12-7-9-3-5-15(8-9)10-11(16)14(2)6-4-13-10/h4,6,9,12H,3,5,7-8H2,1-2H3
InChIKeyWEIUKJAEFQPVCS-UHFFFAOYSA-N
MW222.29 g/mol
LogP-0.17
Rot. Bonds3

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

1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one (PubChem CID 63267799) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one.

Molecular Properties

Compound Name1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one
PubChem CID63267799
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one
SMILESCNCC1CCN(c2nccn(C)c2=O)C1
InChIInChI=1S/C11H18N4O/c1-12-7-9-3-5-15(8-9)10-11(16)14(2)6-4-13-10/h4,6,9,12H,3,5,7-8H2,1-2H3
InChIKeyWEIUKJAEFQPVCS-UHFFFAOYSA-N
XLogP-0.17
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-3-[3-(methylaminomethyl)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

Related Compounds

3-[3-(chloromethyl)pyrrolidin-1-yl]-1-methylpyrazin-2-one
CID 63390246
3-[(3S)-3-aminopyrrolidin-1-yl]-1-methylpyrazin-2-one
CID 94897001
3-[4-[(cyclopropylamino)methyl]piperidin-1-yl]-1-methylpyrazin-2-one
CID 62938713
3-[(3R)-3-hydroxypyrrolidin-1-yl]-1-methylpyrazin-2-one
CID 103696647
3-[4-(2-aminoethyl)piperidin-1-yl]-1-methylpyrazin-2-one
CID 62940456
1-tert-butyl-3-[4-(methylaminomethyl)piperidin-1-yl]pyrazin-2-one
CID 62928367
methyl 1-(4-methyl-3-oxopyrazin-2-yl)pyrrolidine-3-carboxylate
CID 79033439
N-tert-butyl-1-(4-methyl-3-oxopyrazin-2-yl)pyrrolidine-3-carboxamide
CID 155799700
3-[3-[2-(2-methoxyphenyl)ethyl]pyrrolidin-1-yl]-1-methylpyrazin-2-one
CID 158598065
3-[(3R)-3-aminopiperidin-1-yl]-1-methylpyrazin-2-one
CID 94896992
3-[4-[[(1S)-cyclohex-3-en-1-yl]methylamino]piperidin-1-yl]-1-methylpyrazin-2-one
CID 129343770
3-(3-hydroxypiperidin-1-yl)-1-methylpyrazin-2-one
CID 62940622

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one?
The IUPAC name of 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one (CID 63267799) is 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one.
What is the SMILES notation for 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one?
The canonical SMILES for 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one is CNCC1CCN(c2nccn(C)c2=O)C1.
What is the InChIKey of 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one?
The InChIKey is WEIUKJAEFQPVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-12-7-9-3-5-15(8-9)10-11(16)14(2)6-4-13-10/h4,6,9,12H,3,5,7-8H2,1-2H3.
What are the key properties of 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one?
1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one has a molecular weight of 222.29 g/mol, XLogP of -0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[3-(methylaminomethyl)pyrrolidin-1-yl]pyrazin-2-one is sourced from PubChem (CID 63267799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).