3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione

C15H16Cl2N2O2 — CID 107653742

IUPAC3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC1CCCC2(C1)NC(=O)N(c1cc(Cl)ccc1Cl)C2=O
InChIInChI=1S/C15H16Cl2N2O2/c1-9-3-2-6-15(8-9)13(20)19(14(21)18-15)12-7-10(16)4-5-11(12)17/h4-5,7,9H,2-3,6,8H2,1H3,(H,18,21)
InChIKeyXWBVPWDFNBUSBL-UHFFFAOYSA-N
MW327.21 g/mol
LogP4.00
Rot. Bonds1

About 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione

3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 107653742) has the molecular formula C15H16Cl2N2O2 and a molecular weight of 327.21 g/mol. Its IUPAC name is 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID107653742
Molecular FormulaC15H16Cl2N2O2
Molecular Weight327.21 g/mol
Exact Mass326.06
IUPAC Name3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC1CCCC2(C1)NC(=O)N(c1cc(Cl)ccc1Cl)C2=O
InChIInChI=1S/C15H16Cl2N2O2/c1-9-3-2-6-15(8-9)13(20)19(14(21)18-15)12-7-10(16)4-5-11(12)17/h4-5,7,9H,2-3,6,8H2,1H3,(H,18,21)
InChIKeyXWBVPWDFNBUSBL-UHFFFAOYSA-N
XLogP4.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.21
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-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

3-(3,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 107653741
3-(3-chloro-4-methylphenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 61293928
5-cyclopropyl-3-(2,5-dichlorophenyl)-5-methylimidazolidine-2,4-dione
CID 106702974
3-(2-methoxyphenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 61293927
3-(4-chloro-2-fluorophenyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 58035722
9-(2,5-dichlorophenyl)-7,9-diazaspiro[4.5]decane-8,10-dione
CID 107653849
(3aS,5R,7aS)-2-(2,5-dichlorophenyl)-5-methyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 124713079
3-butyl-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 61293566
3-chloro-1-(2,5-dichlorophenyl)-4-(3-methylpiperidin-1-yl)pyrrole-2,5-dione
CID 2791459
(1R,2R,6S,7S)-4-(2,5-dichlorophenyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CID 11871846
3-(4-chlorophenyl)-1,3-diazaspiro[4.5]decane-2,4-dione;methane
CID 143728934
3-(4-chlorophenyl)-8-ethyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 61295440

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione (CID 107653742) is 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione is CC1CCCC2(C1)NC(=O)N(c1cc(Cl)ccc1Cl)C2=O.
What is the InChIKey of 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is XWBVPWDFNBUSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O2/c1-9-3-2-6-15(8-9)13(20)19(14(21)18-15)12-7-10(16)4-5-11(12)17/h4-5,7,9H,2-3,6,8H2,1H3,(H,18,21).
What are the key properties of 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 327.21 g/mol, XLogP of 4.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dichlorophenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 107653742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).