1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one

C14H25NO2 — CID 113421234

IUPAC1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one
SMILESCC(C)C1CC(=O)N(CCC2CCCC2O)C1
InChIInChI=1S/C14H25NO2/c1-10(2)12-8-14(17)15(9-12)7-6-11-4-3-5-13(11)16/h10-13,16H,3-9H2,1-2H3
InChIKeyLWUIYMCKULLQKZ-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.04
Rot. Bonds4

About 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one

1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one (PubChem CID 113421234) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one
PubChem CID113421234
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one
SMILESCC(C)C1CC(=O)N(CCC2CCCC2O)C1
InChIInChI=1S/C14H25NO2/c1-10(2)12-8-14(17)15(9-12)7-6-11-4-3-5-13(11)16/h10-13,16H,3-9H2,1-2H3
InChIKeyLWUIYMCKULLQKZ-UHFFFAOYSA-N
XLogP2.04
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-hydroxypropyl)-4-propan-2-ylpyrrolidin-2-one
CID 115773389
1-ethyl-4-propan-2-ylpyrrolidin-2-one
CID 122470396
2-[(4S)-2-oxo-4-propan-2-ylpyrrolidin-1-yl]acetic acid
CID 97000523
1-(2-aminoethyl)-4-propan-2-ylpyrrolidin-2-one;ethane;formaldehyde;molecular hydrogen
CID 171546139
1-[[4-(hydroxymethyl)phenyl]methyl]-4-propan-2-ylpyrrolidin-2-one
CID 104512318
1-(3-chloro-2-hydroxypropyl)-4-propan-2-ylpyrrolidin-2-one
CID 104511295
1-[3-(2-methylpropylamino)propyl]-4-propan-2-ylpyrrolidin-2-one
CID 104511445
4-[2-(2-oxo-4-propan-2-ylpyrrolidin-1-yl)ethoxy]benzoic acid
CID 104511173
(4S)-1-methyl-4-propan-2-ylpyrrolidin-2-one
CID 129101287
1-(oxiran-2-ylmethyl)-4-propan-2-ylpyrrolidin-2-one
CID 104511611
2-acetamido-3-(2-oxo-4-propan-2-ylpyrrolidin-1-yl)propanoic acid
CID 104511158
4-propan-2-yl-1-[[1-(sulfanylmethyl)cycloheptyl]methyl]pyrrolidin-2-one
CID 104512909

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one?
The IUPAC name of 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one (CID 113421234) is 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one.
What is the SMILES notation for 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one?
The canonical SMILES for 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one is CC(C)C1CC(=O)N(CCC2CCCC2O)C1.
What is the InChIKey of 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one?
The InChIKey is LWUIYMCKULLQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-10(2)12-8-14(17)15(9-12)7-6-11-4-3-5-13(11)16/h10-13,16H,3-9H2,1-2H3.
What are the key properties of 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one?
1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one has a molecular weight of 239.36 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxycyclopentyl)ethyl]-4-propan-2-ylpyrrolidin-2-one is sourced from PubChem (CID 113421234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).