N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide

C12H18N2O3S — CID 110740572

IUPACN,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide
SMILESCC1OC(c2ccccc2)CN1S(=O)(=O)N(C)C
InChIInChI=1S/C12H18N2O3S/c1-10-14(18(15,16)13(2)3)9-12(17-10)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3
InChIKeyOHVBBRSRUGNHEV-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.21
Rot. Bonds3

About N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide

N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide (PubChem CID 110740572) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide.

Molecular Properties

Compound NameN,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide
PubChem CID110740572
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC NameN,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide
SMILESCC1OC(c2ccccc2)CN1S(=O)(=O)N(C)C
InChIInChI=1S/C12H18N2O3S/c1-10-14(18(15,16)13(2)3)9-12(17-10)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3
InChIKeyOHVBBRSRUGNHEV-UHFFFAOYSA-N
XLogP1.21
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-methylsulfonyl-5-phenyl-1,3-oxazolidine
CID 110740568
(2R,5S)-N,N,5-trimethyl-2-phenylmorpholine-4-sulfonamide
CID 95177243
(2S,6R)-2-cyclopropyl-N,N-dimethyl-6-phenylmorpholine-4-sulfonamide
CID 134709238
3-(4-ethoxyphenyl)sulfonyl-2-methyl-5-phenyl-1,3-oxazolidine
CID 110740592
3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-2-methyl-5-phenyl-1,3-oxazolidine
CID 110740590
(2R,5R)-2-(3-chlorophenyl)-N,N,5-trimethylmorpholine-4-sulfonamide
CID 99825536
(2R,5S)-2-(3-chlorophenyl)-N,N,5-trimethylmorpholine-4-sulfonamide
CID 99825537
(2-methyl-5-phenyl-1,3-oxazolidin-3-yl)-phenylmethanone
CID 110740529
(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine
CID 98786694
(2S)-4-acetyl-N,N-dimethyl-2-phenylpiperazine-1-sulfonamide
CID 124988810
4-(benzenesulfonyl)-5-methyl-2-phenylmorpholine
CID 110369381
(2R)-N,N-dimethyl-2-phenylpiperazine-1-sulfonamide
CID 94994297

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide?
The IUPAC name of N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide (CID 110740572) is N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide.
What is the SMILES notation for N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide?
The canonical SMILES for N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide is CC1OC(c2ccccc2)CN1S(=O)(=O)N(C)C.
What is the InChIKey of N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide?
The InChIKey is OHVBBRSRUGNHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-10-14(18(15,16)13(2)3)9-12(17-10)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3.
What are the key properties of N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide?
N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide has a molecular weight of 270.35 g/mol, XLogP of 1.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-5-phenyl-1,3-oxazolidine-3-sulfonamide is sourced from PubChem (CID 110740572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).