N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide

C16H24N2O3S — CID 119104065

IUPACN-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide
SMILESO=S(=O)(NCC1CCN(C2CCOC2)CC1)c1ccccc1
InChIInChI=1S/C16H24N2O3S/c19-22(20,16-4-2-1-3-5-16)17-12-14-6-9-18(10-7-14)15-8-11-21-13-15/h1-5,14-15,17H,6-13H2
InChIKeyNIOPIYCBIWRRBG-UHFFFAOYSA-N
MW324.45 g/mol
LogP1.47
Rot. Bonds5

About N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide

N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide (PubChem CID 119104065) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide
PubChem CID119104065
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide
SMILESO=S(=O)(NCC1CCN(C2CCOC2)CC1)c1ccccc1
InChIInChI=1S/C16H24N2O3S/c19-22(20,16-4-2-1-3-5-16)17-12-14-6-9-18(10-7-14)15-8-11-21-13-15/h1-5,14-15,17H,6-13H2
InChIKeyNIOPIYCBIWRRBG-UHFFFAOYSA-N
XLogP1.47
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide 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-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide
CID 119104068
N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 47203502
4-fluoro-N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]benzenesulfonamide
CID 121109566
N-[[1-(thiolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide
CID 91813128
N-(oxan-3-ylmethyl)benzenesulfonamide
CID 47320394
2-methoxy-N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]benzenesulfonamide
CID 121109576
N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-2-phenylethanesulfonamide
CID 121109573
3,5-dimethyl-N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]-1,2-oxazole-4-sulfonamide
CID 119104066
N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]-4-phenyloxane-4-carboxamide
CID 121021220
1-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]-3-(thiophen-2-ylmethyl)urea
CID 119104084
N-[(1-cyclopentylpiperidin-4-yl)methyl]-3-fluorobenzenesulfonamide
CID 16887715
N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]-2-phenylbutanamide
CID 121021211

Frequently Asked Questions

What is the IUPAC name of N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide?
The IUPAC name of N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide (CID 119104065) is N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide.
What is the SMILES notation for N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide?
The canonical SMILES for N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide is O=S(=O)(NCC1CCN(C2CCOC2)CC1)c1ccccc1.
What is the InChIKey of N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide?
The InChIKey is NIOPIYCBIWRRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c19-22(20,16-4-2-1-3-5-16)17-12-14-6-9-18(10-7-14)15-8-11-21-13-15/h1-5,14-15,17H,6-13H2.
What are the key properties of N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide?
N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide has a molecular weight of 324.45 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(oxolan-3-yl)piperidin-4-yl]methyl]benzenesulfonamide is sourced from PubChem (CID 119104065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).