(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one

C11H19NO2 — CID 42259368

IUPAC(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one
SMILESO=C1C[C@@H](CO)CN1C1CCCCC1
InChIInChI=1S/C11H19NO2/c13-8-9-6-11(14)12(7-9)10-4-2-1-3-5-10/h9-10,13H,1-8H2/t9-/m1/s1
InChIKeyQQBIODKHASIBEM-SECBINFHSA-N
MW197.28 g/mol
LogP1.16
Rot. Bonds2

About (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one

(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one (PubChem CID 42259368) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one
PubChem CID42259368
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one
SMILESO=C1C[C@@H](CO)CN1C1CCCCC1
InChIInChI=1S/C11H19NO2/c13-8-9-6-11(14)12(7-9)10-4-2-1-3-5-10/h9-10,13H,1-8H2/t9-/m1/s1
InChIKeyQQBIODKHASIBEM-SECBINFHSA-N
XLogP1.16
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-1-cyclopropyl-4-(hydroxymethyl)pyrrolidin-2-one
CID 42259346
4-(hydroxymethyl)-1-piperidin-4-ylpyrrolidin-2-one
CID 168662980
4-(hydroxymethyl)-1-(4-propan-2-ylcyclohexyl)pyrrolidin-2-one
CID 168661983
1-[(1S,2R)-2-aminocyclohexyl]-4-(hydroxymethyl)pyrrolidin-2-one
CID 168661550
1-cyclohexyl-4-(methylaminomethyl)pyrrolidin-2-one
CID 83533637
4-(hydroxymethyl)-1-(1-propan-2-ylpiperidin-4-yl)pyrrolidin-2-one
CID 117005596
(4R)-1-cyclopentyl-4-(methylaminomethyl)pyrrolidin-2-one
CID 26722502
4-(hydroxymethyl)-1-[1-(3-methylbutyl)piperidin-3-yl]pyrrolidin-2-one
CID 117005709
ethyl 4-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]cyclohexane-1-carboxylate
CID 168662115
3-cyclopentyl-5-(hydroxymethyl)-1,3-oxazinan-2-one
CID 117011500
N-[[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide
CID 99919595
(4S)-1-cyclohexyl-4-methylpyrrolidin-2-one
CID 163909402

Frequently Asked Questions

What is the IUPAC name of (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one?
The IUPAC name of (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one (CID 42259368) is (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one is O=C1C[C@@H](CO)CN1C1CCCCC1.
What is the InChIKey of (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one?
The InChIKey is QQBIODKHASIBEM-SECBINFHSA-N. The full InChI is InChI=1S/C11H19NO2/c13-8-9-6-11(14)12(7-9)10-4-2-1-3-5-10/h9-10,13H,1-8H2/t9-/m1/s1.
What are the key properties of (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one?
(4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-cyclohexyl-4-(hydroxymethyl)pyrrolidin-2-one is sourced from PubChem (CID 42259368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).