N-(1-propylpiperidin-4-yl)methanesulfonamide

C9H20N2O2S — CID 21328012

IUPACN-(1-propylpiperidin-4-yl)methanesulfonamide
SMILESCCCN1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H20N2O2S/c1-3-6-11-7-4-9(5-8-11)10-14(2,12)13/h9-10H,3-8H2,1-2H3
InChIKeyORJYXYORHXYLJD-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.41
Rot. Bonds4

About N-(1-propylpiperidin-4-yl)methanesulfonamide

N-(1-propylpiperidin-4-yl)methanesulfonamide (PubChem CID 21328012) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(1-propylpiperidin-4-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-propylpiperidin-4-yl)methanesulfonamide
PubChem CID21328012
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(1-propylpiperidin-4-yl)methanesulfonamide
SMILESCCCN1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H20N2O2S/c1-3-6-11-7-4-9(5-8-11)10-14(2,12)13/h9-10H,3-8H2,1-2H3
InChIKeyORJYXYORHXYLJD-UHFFFAOYSA-N
XLogP0.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-propylpiperidin-4-yl)methanesulfonamide 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

N-(Piperidin-4-yl)methanesulfonamide
CID 16227261
1-(Methanesulfonyl)piperidin-4-amine
CID 11355826
1-(Methanesulfonyl)-3-aminopiperidine
CID 19623288
N-(piperidin-3-yl)methanesulfonamide
CID 20113226
4-Amino-1-ethanesulfonylpiperidine
CID 16776186
1-Methanesulfonylpiperidin-4-amine hydrochloride
CID 17221636
N-((piperidin-2-yl)methyl)methanesulfonamide
CID 18070091
N-(piperidin-4-yl)methanesulfonamide hydrochloride
CID 20569935
1-(Propane-2-sulfonyl)piperidin-4-amine hydrochloride
CID 21090391
1-Methanesulfonylpiperidin-3-amine hydrochloride
CID 45792405
N-methyl-N-(piperidin-4-yl)methanesulfonamide hydrochloride
CID 45792536
1-(2-Methanesulfonylethyl)piperidin-4-amine
CID 49817087

Frequently Asked Questions

What is the IUPAC name of N-(1-propylpiperidin-4-yl)methanesulfonamide?
The IUPAC name of N-(1-propylpiperidin-4-yl)methanesulfonamide (CID 21328012) is N-(1-propylpiperidin-4-yl)methanesulfonamide.
What is the SMILES notation for N-(1-propylpiperidin-4-yl)methanesulfonamide?
The canonical SMILES for N-(1-propylpiperidin-4-yl)methanesulfonamide is CCCN1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-(1-propylpiperidin-4-yl)methanesulfonamide?
The InChIKey is ORJYXYORHXYLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-3-6-11-7-4-9(5-8-11)10-14(2,12)13/h9-10H,3-8H2,1-2H3.
What are the key properties of N-(1-propylpiperidin-4-yl)methanesulfonamide?
N-(1-propylpiperidin-4-yl)methanesulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propylpiperidin-4-yl)methanesulfonamide is sourced from PubChem (CID 21328012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).