N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine

C9H19N3O2S — CID 114811401

IUPACN-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine
SMILESCC1(NS(=O)(=O)NC2CC2)CCNCC1
InChIInChI=1S/C9H19N3O2S/c1-9(4-6-10-7-5-9)12-15(13,14)11-8-2-3-8/h8,10-12H,2-7H2,1H3
InChIKeyZPJZFEOFPFCCAY-UHFFFAOYSA-N
MW233.34 g/mol
LogP-0.29
Rot. Bonds4

About N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine

N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine (PubChem CID 114811401) has the molecular formula C9H19N3O2S and a molecular weight of 233.34 g/mol. Its IUPAC name is N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine
PubChem CID114811401
Molecular FormulaC9H19N3O2S
Molecular Weight233.34 g/mol
Exact Mass233.12
IUPAC NameN-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine
SMILESCC1(NS(=O)(=O)NC2CC2)CCNCC1
InChIInChI=1S/C9H19N3O2S/c1-9(4-6-10-7-5-9)12-15(13,14)11-8-2-3-8/h8,10-12H,2-7H2,1H3
InChIKeyZPJZFEOFPFCCAY-UHFFFAOYSA-N
XLogP-0.29
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The IUPAC name of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine (CID 114811401) is N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine.
What is the SMILES notation for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The canonical SMILES for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine is CC1(NS(=O)(=O)NC2CC2)CCNCC1.
What is the InChIKey of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
The InChIKey is ZPJZFEOFPFCCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S/c1-9(4-6-10-7-5-9)12-15(13,14)11-8-2-3-8/h8,10-12H,2-7H2,1H3.
What are the key properties of N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine?
N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine has a molecular weight of 233.34 g/mol, XLogP of -0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylsulfamoyl)-4-methylpiperidin-4-amine is sourced from PubChem (CID 114811401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).