1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one

C11H19NO — CID 107413455

IUPAC1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one
SMILESCC1CCC(CN2CCC(=O)C2)C1
InChIInChI=1S/C11H19NO/c1-9-2-3-10(6-9)7-12-5-4-11(13)8-12/h9-10H,2-8H2,1H3
InChIKeyRDVUXNXCSCKKED-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.70
Rot. Bonds2

About 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one

1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one (PubChem CID 107413455) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one.

Molecular Properties

Compound Name1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one
PubChem CID107413455
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one
SMILESCC1CCC(CN2CCC(=O)C2)C1
InChIInChI=1S/C11H19NO/c1-9-2-3-10(6-9)7-12-5-4-11(13)8-12/h9-10H,2-8H2,1H3
InChIKeyRDVUXNXCSCKKED-UHFFFAOYSA-N
XLogP1.70
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopentylmethyl)pyrrolidin-3-one
CID 43371123
1-(oxolan-3-ylmethyl)pyrrolidin-3-one
CID 62823822
ethyl 4-[(3-oxopyrrolidin-1-yl)methyl]cyclohexane-1-carboxylate
CID 67936903
1-(3-methylcyclopentyl)pyrrolidin-3-one
CID 114546729
1-(piperidin-3-ylmethyl)pyrrolidin-3-one;hydrochloride
CID 115031072
1-[[(3S)-3,6-dimethylcycloheptyl]methyl]piperidine
CID 137427496
1-[[4-(hydroxymethyl)cyclohexyl]methyl]piperidin-4-one
CID 172590869
1-[(3-methylcyclopentyl)methyl]piperazin-2-one
CID 107415470
3-methyl-1-[(3-methylcyclopentyl)methyl]-1,5-diazocane
CID 107415122
6-[(4-methylcyclohexyl)methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 140917758
1-[(1-methylpyrrolidin-3-yl)methyl]piperidin-4-one
CID 60854921
4-[(4-methylcyclohexyl)methyl]morpholine-2,6-dione
CID 63789772

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one?
The IUPAC name of 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one (CID 107413455) is 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one.
What is the SMILES notation for 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one?
The canonical SMILES for 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one is CC1CCC(CN2CCC(=O)C2)C1.
What is the InChIKey of 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one?
The InChIKey is RDVUXNXCSCKKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-9-2-3-10(6-9)7-12-5-4-11(13)8-12/h9-10H,2-8H2,1H3.
What are the key properties of 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one?
1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one has a molecular weight of 181.28 g/mol, XLogP of 1.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methylcyclopentyl)methyl]pyrrolidin-3-one is sourced from PubChem (CID 107413455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).