[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene

C16H20N2O2S — CID 155181880

IUPAC[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene
SMILESCN(C(Cc1ccccc1)Cc1ccccc1)S(N)(=O)=O
InChIInChI=1S/C16H20N2O2S/c1-18(21(17,19)20)16(12-14-8-4-2-5-9-14)13-15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H2,17,19,20)
InChIKeyOQBBFPYTWOVFBG-UHFFFAOYSA-N
MW304.42 g/mol
LogP1.98
Rot. Bonds6

About [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene

[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene (PubChem CID 155181880) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene.

Molecular Properties

Compound Name[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene
PubChem CID155181880
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC Name[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene
SMILESCN(C(Cc1ccccc1)Cc1ccccc1)S(N)(=O)=O
InChIInChI=1S/C16H20N2O2S/c1-18(21(17,19)20)16(12-14-8-4-2-5-9-14)13-15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H2,17,19,20)
InChIKeyOQBBFPYTWOVFBG-UHFFFAOYSA-N
XLogP1.98
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-methyl-3-phenyl-2-N-(2-phenylethyl)propane-1,2-diamine
CID 65483135
1,3-diphenylpropane-2-sulfonamide
CID 62084735
N,N-dimethyl-1-phenylbutan-2-amine
CID 14527584
2-benzylbutane-1-sulfonamide
CID 68809257
λ2-plumbane;bis((2S)-1-phenylpropan-2-amine);sulfuric acid
CID 173242520
(1S)-1,2-diphenylethanesulfonamide
CID 15655609
[2-(1,3-diphenylpropan-2-ylsulfonyl)-3-phenylpropyl]benzene
CID 175219227
3-phenyl-2-sulfamoylpropanoic acid
CID 70062822
methanesulfonic acid;1-phenylpropan-2-amine
CID 173025540
methanesulfonic acid;(2S)-1-phenylpropan-2-amine
CID 87182702
4-amino-N-methyl-N-(1-phenylbutan-2-yl)pentanamide;hydrochloride
CID 120563414
1,3-bis(benzylsulfonylsulfanyl)-N,N-dimethylpropan-2-amine
CID 14692957

Frequently Asked Questions

What is the IUPAC name of [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene?
The IUPAC name of [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene (CID 155181880) is [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene.
What is the SMILES notation for [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene?
The canonical SMILES for [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene is CN(C(Cc1ccccc1)Cc1ccccc1)S(N)(=O)=O.
What is the InChIKey of [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene?
The InChIKey is OQBBFPYTWOVFBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-18(21(17,19)20)16(12-14-8-4-2-5-9-14)13-15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H2,17,19,20).
What are the key properties of [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene?
[2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene has a molecular weight of 304.42 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl(sulfamoyl)amino]-3-phenylpropyl]benzene is sourced from PubChem (CID 155181880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).