(5R)-5-(2-methylphenyl)pyrrolidin-2-one

C11H13NO — CID 124706826

IUPAC(5R)-5-(2-methylphenyl)pyrrolidin-2-one
SMILESCc1ccccc1[C@H]1CCC(=O)N1
InChIInChI=1S/C11H13NO/c1-8-4-2-3-5-9(8)10-6-7-11(13)12-10/h2-5,10H,6-7H2,1H3,(H,12,13)/t10-/m1/s1
InChIKeyTWHSDYRKQLDXAD-SNVBAGLBSA-N
MW175.23 g/mol
LogP1.95
Rot. Bonds1

About (5R)-5-(2-methylphenyl)pyrrolidin-2-one

(5R)-5-(2-methylphenyl)pyrrolidin-2-one (PubChem CID 124706826) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is (5R)-5-(2-methylphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-5-(2-methylphenyl)pyrrolidin-2-one
PubChem CID124706826
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name(5R)-5-(2-methylphenyl)pyrrolidin-2-one
SMILESCc1ccccc1[C@H]1CCC(=O)N1
InChIInChI=1S/C11H13NO/c1-8-4-2-3-5-9(8)10-6-7-11(13)12-10/h2-5,10H,6-7H2,1H3,(H,12,13)/t10-/m1/s1
InChIKeyTWHSDYRKQLDXAD-SNVBAGLBSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5S)-5-(2-ethylphenyl)pyrrolidin-2-one
CID 130615199
6-methyl-5-(2-methylphenyl)piperidin-2-one
CID 123290558
(5R)-5-(3-chloro-2-methylphenyl)pyrrolidin-2-one
CID 130751967
(2S)-2-(2-methylphenyl)-2,3-dihydro-1H-pyridin-4-one
CID 14943005
(7R)-7-(2-methylphenyl)-3-propan-2-yl-5,6,7,8-tetrahydro-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 121426445
5-(2-methylphenyl)-2-propan-2-ylpyrazolidin-3-one
CID 105472926
1-ethyl-4-(2-methylphenyl)imidazolidin-2-one
CID 116981049
2-(2-methylphenyl)-1,3-thiazolidin-4-one
CID 23215000
4,7-dimethyl-2-(2-methylphenyl)-2,3-dihydro-1H-indole
CID 4657954
6-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)-1,3-diazinan-4-one
CID 73369318
5-(2-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid
CID 13416193
(3R)-1-methyl-3-(2-methylphenyl)piperazine-2,5-dione
CID 51893600

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(2-methylphenyl)pyrrolidin-2-one?
The IUPAC name of (5R)-5-(2-methylphenyl)pyrrolidin-2-one (CID 124706826) is (5R)-5-(2-methylphenyl)pyrrolidin-2-one.
What is the SMILES notation for (5R)-5-(2-methylphenyl)pyrrolidin-2-one?
The canonical SMILES for (5R)-5-(2-methylphenyl)pyrrolidin-2-one is Cc1ccccc1[C@H]1CCC(=O)N1.
What is the InChIKey of (5R)-5-(2-methylphenyl)pyrrolidin-2-one?
The InChIKey is TWHSDYRKQLDXAD-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13NO/c1-8-4-2-3-5-9(8)10-6-7-11(13)12-10/h2-5,10H,6-7H2,1H3,(H,12,13)/t10-/m1/s1.
What are the key properties of (5R)-5-(2-methylphenyl)pyrrolidin-2-one?
(5R)-5-(2-methylphenyl)pyrrolidin-2-one has a molecular weight of 175.23 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(2-methylphenyl)pyrrolidin-2-one is sourced from PubChem (CID 124706826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).