8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane

C14H18Cl2N2O2S — CID 67480503

IUPAC8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane
SMILESO=S(=O)(c1cc(Cl)cc(Cl)c1)N1CCC2(CCNC2)CC1
InChIInChI=1S/C14H18Cl2N2O2S/c15-11-7-12(16)9-13(8-11)21(19,20)18-5-2-14(3-6-18)1-4-17-10-14/h7-9,17H,1-6,10H2
InChIKeyNNJFNOSVFZKVCO-UHFFFAOYSA-N
MW349.28 g/mol
LogP2.76
Rot. Bonds2

About 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane

8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane (PubChem CID 67480503) has the molecular formula C14H18Cl2N2O2S and a molecular weight of 349.28 g/mol. Its IUPAC name is 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane
PubChem CID67480503
Molecular FormulaC14H18Cl2N2O2S
Molecular Weight349.28 g/mol
Exact Mass348.05
IUPAC Name8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane
SMILESO=S(=O)(c1cc(Cl)cc(Cl)c1)N1CCC2(CCNC2)CC1
InChIInChI=1S/C14H18Cl2N2O2S/c15-11-7-12(16)9-13(8-11)21(19,20)18-5-2-14(3-6-18)1-4-17-10-14/h7-9,17H,1-6,10H2
InChIKeyNNJFNOSVFZKVCO-UHFFFAOYSA-N
XLogP2.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.28
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane 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 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane (CID 67480503) is 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane is O=S(=O)(c1cc(Cl)cc(Cl)c1)N1CCC2(CCNC2)CC1.
What is the InChIKey of 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane?
The InChIKey is NNJFNOSVFZKVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O2S/c15-11-7-12(16)9-13(8-11)21(19,20)18-5-2-14(3-6-18)1-4-17-10-14/h7-9,17H,1-6,10H2.
What are the key properties of 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane?
8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane has a molecular weight of 349.28 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 67480503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).