1'-methylspiro[1H-indene-3,3'-azetidine]-2-one

C12H13NO — CID 170719350

IUPAC1'-methylspiro[1H-indene-3,3'-azetidine]-2-one
SMILESCN1CC2(C1)C(=O)Cc1ccccc12
InChIInChI=1S/C12H13NO/c1-13-7-12(8-13)10-5-3-2-4-9(10)6-11(12)14/h2-5H,6-8H2,1H3
InChIKeyLANFMENVICUNSY-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.00
Rot. Bonds

About 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one

1'-methylspiro[1H-indene-3,3'-azetidine]-2-one (PubChem CID 170719350) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one.

Molecular Properties

Compound Name1'-methylspiro[1H-indene-3,3'-azetidine]-2-one
PubChem CID170719350
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name1'-methylspiro[1H-indene-3,3'-azetidine]-2-one
SMILESCN1CC2(C1)C(=O)Cc1ccccc12
InChIInChI=1S/C12H13NO/c1-13-7-12(8-13)10-5-3-2-4-9(10)6-11(12)14/h2-5H,6-8H2,1H3
InChIKeyLANFMENVICUNSY-UHFFFAOYSA-N
XLogP1.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one?
The IUPAC name of 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one (CID 170719350) is 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one.
What is the SMILES notation for 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one?
The canonical SMILES for 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one is CN1CC2(C1)C(=O)Cc1ccccc12.
What is the InChIKey of 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one?
The InChIKey is LANFMENVICUNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-13-7-12(8-13)10-5-3-2-4-9(10)6-11(12)14/h2-5H,6-8H2,1H3.
What are the key properties of 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one?
1'-methylspiro[1H-indene-3,3'-azetidine]-2-one has a molecular weight of 187.24 g/mol, XLogP of 1.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[1H-indene-3,3'-azetidine]-2-one is sourced from PubChem (CID 170719350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).