3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide

C16H22N2O5S — CID 2963679

IUPAC3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
SMILESO=C(NCC1CCCO1)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C16H22N2O5S/c19-16(17-12-14-4-2-8-23-14)13-3-1-5-15(11-13)24(20,21)18-6-9-22-10-7-18/h1,3,5,11,14H,2,4,6-10,12H2,(H,17,19)
InChIKeyXSSOCRPIECVAPR-UHFFFAOYSA-N
MW354.43 g/mol
LogP0.62
Rot. Bonds5

About 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide

3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 2963679) has the molecular formula C16H22N2O5S and a molecular weight of 354.43 g/mol. Its IUPAC name is 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
PubChem CID2963679
Molecular FormulaC16H22N2O5S
Molecular Weight354.43 g/mol
Exact Mass354.12
IUPAC Name3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
SMILESO=C(NCC1CCCO1)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C16H22N2O5S/c19-16(17-12-14-4-2-8-23-14)13-3-1-5-15(11-13)24(20,21)18-6-9-22-10-7-18/h1,3,5,11,14H,2,4,6-10,12H2,(H,17,19)
InChIKeyXSSOCRPIECVAPR-UHFFFAOYSA-N
XLogP0.62
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide 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

3-(1,4-oxazepan-4-ylsulfonyl)-N-(oxolan-2-ylmethyl)benzamide
CID 72929925
3-(4-methylpiperidin-1-yl)sulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 2953675
2-methyl-5-morpholin-4-ylsulfonyl-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7379557
2-methyl-5-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 2994738
3-chloro-4-morpholin-4-ylsulfonyl-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 34551600
5-morpholin-4-ylsulfonyl-N-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-ylbenzamide
CID 25361107
3-(methylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
CID 51160994
2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]acetic acid
CID 24691198
4-methoxy-3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 18892278
N-(oxolan-2-ylmethyl)-3-(phenylsulfamoyl)benzamide
CID 19257393
4-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7436349
3-morpholin-4-ylsulfonyl-N-prop-2-enylbenzamide
CID 2711286

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide (CID 2963679) is 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide is O=C(NCC1CCCO1)c1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is XSSOCRPIECVAPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O5S/c19-16(17-12-14-4-2-8-23-14)13-3-1-5-15(11-13)24(20,21)18-6-9-22-10-7-18/h1,3,5,11,14H,2,4,6-10,12H2,(H,17,19).
What are the key properties of 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide?
3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 354.43 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 2963679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).