3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one

C10H19N3O — CID 164647012

IUPAC3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one
SMILESCN1CCCC(NC2CCNC2=O)C1
InChIInChI=1S/C10H19N3O/c1-13-6-2-3-8(7-13)12-9-4-5-11-10(9)14/h8-9,12H,2-7H2,1H3,(H,11,14)
InChIKeyRWYACZDUPANBNY-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.44
Rot. Bonds2

About 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one

3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one (PubChem CID 164647012) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one.

Molecular Properties

Compound Name3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one
PubChem CID164647012
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one
SMILESCN1CCCC(NC2CCNC2=O)C1
InChIInChI=1S/C10H19N3O/c1-13-6-2-3-8(7-13)12-9-4-5-11-10(9)14/h8-9,12H,2-7H2,1H3,(H,11,14)
InChIKeyRWYACZDUPANBNY-UHFFFAOYSA-N
XLogP-0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(1-methylazetidin-3-yl)amino]azepan-2-one
CID 127013470
4-[(1-methylpiperidin-3-yl)amino]azepan-2-one
CID 63887519
3-[(3-aminocyclohexyl)amino]pyrrolidin-2-one
CID 164647017
3-[(1-propylazepan-4-yl)amino]azepan-2-one
CID 65074113
1-methyl-4-[(1-methylpyrrolidin-3-yl)amino]pyrazolidin-3-one
CID 130892992
N-(1,1-dioxothian-4-yl)-1-methylpiperidin-3-amine
CID 61210849
3-[(3-methylcyclohexyl)amino]piperidin-2-one
CID 62092837
1-methyl-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-3-amine
CID 81327342
1-methyl-N-(2-methylcyclobutyl)piperidin-3-amine
CID 126973384
(3R)-3-[[(1R,3S)-3-methylcyclohexyl]amino]azepan-2-one
CID 40501731
3-[(3,5-dimethylcyclohexyl)amino]piperidin-2-one
CID 64751431
3-[(1,1-dioxothian-4-yl)amino]piperidin-2-one
CID 62093934

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one?
The IUPAC name of 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one (CID 164647012) is 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one.
What is the SMILES notation for 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one?
The canonical SMILES for 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one is CN1CCCC(NC2CCNC2=O)C1.
What is the InChIKey of 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one?
The InChIKey is RWYACZDUPANBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-13-6-2-3-8(7-13)12-9-4-5-11-10(9)14/h8-9,12H,2-7H2,1H3,(H,11,14).
What are the key properties of 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one?
3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of -0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methylpiperidin-3-yl)amino]pyrrolidin-2-one is sourced from PubChem (CID 164647012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).