N-(phenylsulfamoyl)adamantan-1-amine

C16H22N2O2S — CID 134204498

IUPACN-(phenylsulfamoyl)adamantan-1-amine
SMILESO=S(=O)(Nc1ccccc1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H22N2O2S/c19-21(20,17-15-4-2-1-3-5-15)18-16-9-12-6-13(10-16)8-14(7-12)11-16/h1-5,12-14,17-18H,6-11H2
InChIKeyCYIGAAFBTCTHLQ-UHFFFAOYSA-N
MW306.43 g/mol
LogP2.90
Rot. Bonds4

About N-(phenylsulfamoyl)adamantan-1-amine

N-(phenylsulfamoyl)adamantan-1-amine (PubChem CID 134204498) has the molecular formula C16H22N2O2S and a molecular weight of 306.43 g/mol. Its IUPAC name is N-(phenylsulfamoyl)adamantan-1-amine.

Molecular Properties

Compound NameN-(phenylsulfamoyl)adamantan-1-amine
PubChem CID134204498
Molecular FormulaC16H22N2O2S
Molecular Weight306.43 g/mol
Exact Mass306.14
IUPAC NameN-(phenylsulfamoyl)adamantan-1-amine
SMILESO=S(=O)(Nc1ccccc1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C16H22N2O2S/c19-21(20,17-15-4-2-1-3-5-15)18-16-9-12-6-13(10-16)8-14(7-12)11-16/h1-5,12-14,17-18H,6-11H2
InChIKeyCYIGAAFBTCTHLQ-UHFFFAOYSA-N
XLogP2.90
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.43
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(phenylsulfamoyl)adamantan-1-amine 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 N-(phenylsulfamoyl)adamantan-1-amine?
The IUPAC name of N-(phenylsulfamoyl)adamantan-1-amine (CID 134204498) is N-(phenylsulfamoyl)adamantan-1-amine.
What is the SMILES notation for N-(phenylsulfamoyl)adamantan-1-amine?
The canonical SMILES for N-(phenylsulfamoyl)adamantan-1-amine is O=S(=O)(Nc1ccccc1)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(phenylsulfamoyl)adamantan-1-amine?
The InChIKey is CYIGAAFBTCTHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2S/c19-21(20,17-15-4-2-1-3-5-15)18-16-9-12-6-13(10-16)8-14(7-12)11-16/h1-5,12-14,17-18H,6-11H2.
What are the key properties of N-(phenylsulfamoyl)adamantan-1-amine?
N-(phenylsulfamoyl)adamantan-1-amine has a molecular weight of 306.43 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(phenylsulfamoyl)adamantan-1-amine is sourced from PubChem (CID 134204498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).