7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

C10H11NO2 — CID 159140076

IUPAC7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCC1=CC2(C=CC1=O)CCC(=O)N2
InChIInChI=1S/C10H11NO2/c1-7-6-10(4-2-8(7)12)5-3-9(13)11-10/h2,4,6H,3,5H2,1H3,(H,11,13)
InChIKeyKHZIDURXVRHSSN-UHFFFAOYSA-N
MW177.20 g/mol
LogP0.72
Rot. Bonds

About 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 159140076) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID159140076
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCC1=CC2(C=CC1=O)CCC(=O)N2
InChIInChI=1S/C10H11NO2/c1-7-6-10(4-2-8(7)12)5-3-9(13)11-10/h2,4,6H,3,5H2,1H3,(H,11,13)
InChIKeyKHZIDURXVRHSSN-UHFFFAOYSA-N
XLogP0.72
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione with MolForge

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

Launch Full Analysis

Related Compounds

1-Azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 129877203
1-Methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11298476
1-Methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11031019
1-Azaspiro[4.5]dec-3-ene-2,8-dione
CID 59541097
N-(2-methyl-3-oxopentan-2-yl)cyclohexa-1,3-diene-1-carboxamide
CID 70639778
(3Z)-3-ethylidene-5,5-dimethylpyrrolidin-2-one
CID 133667696
7,9-Dimethyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 139312089
7-Methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 139312600
3,3-dimethyl-5,6-dihydro-2H-isoindol-1-one;ethane
CID 141799601
7-Bromo-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 142619125
1-Azaspiro[4.5]deca-6,9-dien-2-one
CID 152560812
(3Z)-3-(3-aminopropylidene)-5,5-dimethylpyrrolidin-2-one
CID 156623696

Frequently Asked Questions

What is the IUPAC name of 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 159140076) is 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is CC1=CC2(C=CC1=O)CCC(=O)N2.
What is the InChIKey of 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is KHZIDURXVRHSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-7-6-10(4-2-8(7)12)5-3-9(13)11-10/h2,4,6H,3,5H2,1H3,(H,11,13).
What are the key properties of 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione has a molecular weight of 177.20 g/mol, XLogP of 0.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 159140076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).