(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide

C16H22N2O5S — CID 7979090

IUPAC(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
SMILESCc1ccc(NC(=O)[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H22N2O5S/c1-12-4-5-13(17-16(19)14-3-2-8-23-14)11-15(12)24(20,21)18-6-9-22-10-7-18/h4-5,11,14H,2-3,6-10H2,1H3,(H,17,19)/t14-/m1/s1
InChIKeyYPSITKHYNUPYGK-CQSZACIVSA-N
MW354.43 g/mol
LogP1.13
Rot. Bonds4

About (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide

(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide (PubChem CID 7979090) has the molecular formula C16H22N2O5S and a molecular weight of 354.43 g/mol. Its IUPAC name is (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
PubChem CID7979090
Molecular FormulaC16H22N2O5S
Molecular Weight354.43 g/mol
Exact Mass354.12
IUPAC Name(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
SMILESCc1ccc(NC(=O)[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H22N2O5S/c1-12-4-5-13(17-16(19)14-3-2-8-23-14)11-15(12)24(20,21)18-6-9-22-10-7-18/h4-5,11,14H,2-3,6-10H2,1H3,(H,17,19)/t14-/m1/s1
InChIKeyYPSITKHYNUPYGK-CQSZACIVSA-N
XLogP1.13
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 8800265
(2R)-N-(4-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 975970
2,2-dimethyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide
CID 44591253
N-[3-(dimethylsulfamoyl)-4-methylphenyl]oxolane-2-carboxamide
CID 42904547
N-(4-methyl-3-sulfamoylphenyl)oxane-2-carboxamide
CID 62213044
2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 3409401
(4-methyl-3-morpholin-4-ylsulfonylphenyl)thiourea
CID 169358512
tert-butyl 3-[(4-methyl-3-morpholin-4-ylsulfonylphenyl)carbamoyl]piperidine-1-carboxylate
CID 24515330
2-methyl-5-(oxolane-2-carbonylamino)benzoic acid
CID 63652254
N-(3-methyl-4-sulfamoylphenyl)oxolane-2-carboxamide
CID 43133994
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)naphthalene-2-carboxamide
CID 7929134
1-methyl-N-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide
CID 50875261

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide?
The IUPAC name of (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide (CID 7979090) is (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide is Cc1ccc(NC(=O)[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide?
The InChIKey is YPSITKHYNUPYGK-CQSZACIVSA-N. The full InChI is InChI=1S/C16H22N2O5S/c1-12-4-5-13(17-16(19)14-3-2-8-23-14)11-15(12)24(20,21)18-6-9-22-10-7-18/h4-5,11,14H,2-3,6-10H2,1H3,(H,17,19)/t14-/m1/s1.
What are the key properties of (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide?
(2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide has a molecular weight of 354.43 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 7979090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).