5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one

C10H18N2O — CID 107530010

IUPAC5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one
SMILESCC1(NCC2CCC(=O)N2)CCC1
InChIInChI=1S/C10H18N2O/c1-10(5-2-6-10)11-7-8-3-4-9(13)12-8/h8,11H,2-7H2,1H3,(H,12,13)
InChIKeyUSDSTJJQTPUHKL-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.80
Rot. Bonds3

About 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one

5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one (PubChem CID 107530010) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one
PubChem CID107530010
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one
SMILESCC1(NCC2CCC(=O)N2)CCC1
InChIInChI=1S/C10H18N2O/c1-10(5-2-6-10)11-7-8-3-4-9(13)12-8/h8,11H,2-7H2,1H3,(H,12,13)
InChIKeyUSDSTJJQTPUHKL-UHFFFAOYSA-N
XLogP0.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one
CID 103829234
5-[[(2-methyloxolan-2-yl)methylamino]methyl]pyrrolidin-2-one
CID 107529690
(5S)-5-[[[1-(4-fluorophenyl)cyclopentyl]amino]methyl]pyrrolidin-2-one
CID 163218533
(5S)-5-[(prop-2-ynylamino)methyl]pyrrolidin-2-one
CID 166066315
(5S)-5-[(2-methylpropylamino)methyl]pyrrolidin-2-one
CID 139457807
5-[[(2,4,4-trimethylcyclohexyl)amino]methyl]pyrrolidin-2-one
CID 81320803
5-[[(3,3-difluorocyclohexyl)methylamino]methyl]pyrrolidin-2-one
CID 114223835
5-[(cyclooctylamino)methyl]pyrrolidin-2-one
CID 60727135
5-[[2-(dimethylamino)ethylamino]methyl]pyrrolidin-2-one
CID 60726501
5-[(2-cyclopropylpropylamino)methyl]pyrrolidin-2-one
CID 107529963
5-[[(4-hydroxyoxan-4-yl)methylamino]methyl]pyrrolidin-2-one
CID 107529723
5-[[(2-methylcyclohexyl)amino]methyl]pyrrolidin-2-one
CID 60727633

Frequently Asked Questions

What is the IUPAC name of 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one?
The IUPAC name of 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one (CID 107530010) is 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one?
The canonical SMILES for 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one is CC1(NCC2CCC(=O)N2)CCC1.
What is the InChIKey of 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one?
The InChIKey is USDSTJJQTPUHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-10(5-2-6-10)11-7-8-3-4-9(13)12-8/h8,11H,2-7H2,1H3,(H,12,13).
What are the key properties of 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one?
5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one has a molecular weight of 182.27 g/mol, XLogP of 0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-methylcyclobutyl)amino]methyl]pyrrolidin-2-one is sourced from PubChem (CID 107530010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).