(3S)-3-methyl-3-phenylazetidin-2-one

C10H11NO — CID 10329577

IUPAC(3S)-3-methyl-3-phenylazetidin-2-one
SMILESC[C@]1(c2ccccc2)CNC1=O
InChIInChI=1S/C10H11NO/c1-10(7-11-9(10)12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12)/t10-/m1/s1
InChIKeyFWRSXKVUCBPVLE-SNVBAGLBSA-N
MW161.20 g/mol
LogP1.07
Rot. Bonds1

About (3S)-3-methyl-3-phenylazetidin-2-one

(3S)-3-methyl-3-phenylazetidin-2-one (PubChem CID 10329577) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (3S)-3-methyl-3-phenylazetidin-2-one.

Molecular Properties

Compound Name(3S)-3-methyl-3-phenylazetidin-2-one
PubChem CID10329577
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(3S)-3-methyl-3-phenylazetidin-2-one
SMILESC[C@]1(c2ccccc2)CNC1=O
InChIInChI=1S/C10H11NO/c1-10(7-11-9(10)12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12)/t10-/m1/s1
InChIKeyFWRSXKVUCBPVLE-SNVBAGLBSA-N
XLogP1.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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5-amino-1-phenyl-3-azabicyclo[3.1.0]hexan-2-one
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3-(3-methyl-2-oxopyrrolidin-3-yl)benzoic acid
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(3S)-3-(3-methoxyphenyl)-3-methylpyrrolidin-2-one
CID 11264195
5-methyl-2-oxido-5-phenyltriazinane-4,6-dione
CID 163644161
3-methyl-3-phenyloxolan-2-one
CID 15937425
1,6-dimethyl-6-phenylpiperazine-2,5-dione
CID 64879749
9-methyl-9-phenyl-1,4,7-trioxacyclododecan-8-one
CID 10588652
4-ethyl-4-phenylpyrrolidin-2-one
CID 66107809
(3S)-3-ethyl-3-phenylpiperazin-2-one
CID 94410316
3-benzyl-3-methylpyrrolidin-2-one
CID 10420013
1,3-dimethyl-3-phenylpiperidine-2,6-dione
CID 13260886

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-3-phenylazetidin-2-one?
The IUPAC name of (3S)-3-methyl-3-phenylazetidin-2-one (CID 10329577) is (3S)-3-methyl-3-phenylazetidin-2-one.
What is the SMILES notation for (3S)-3-methyl-3-phenylazetidin-2-one?
The canonical SMILES for (3S)-3-methyl-3-phenylazetidin-2-one is C[C@]1(c2ccccc2)CNC1=O.
What is the InChIKey of (3S)-3-methyl-3-phenylazetidin-2-one?
The InChIKey is FWRSXKVUCBPVLE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11NO/c1-10(7-11-9(10)12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12)/t10-/m1/s1.
What are the key properties of (3S)-3-methyl-3-phenylazetidin-2-one?
(3S)-3-methyl-3-phenylazetidin-2-one has a molecular weight of 161.20 g/mol, XLogP of 1.07, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-3-phenylazetidin-2-one is sourced from PubChem (CID 10329577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).