(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide

C18H19NO2S — CID 2375188

IUPAC(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C18H19NO2S/c20-22(21,14-13-15-7-2-1-3-8-15)19-18-12-6-10-16-9-4-5-11-17(16)18/h1-5,7-9,11,13-14,18-19H,6,10,12H2/b14-13+/t18-/m1/s1
InChIKeyMVOJHBQEGYMADK-KAUXGEHWSA-N
MW313.42 g/mol
LogP3.65
Rot. Bonds4

About (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide

(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide (PubChem CID 2375188) has the molecular formula C18H19NO2S and a molecular weight of 313.42 g/mol. Its IUPAC name is (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide
PubChem CID2375188
Molecular FormulaC18H19NO2S
Molecular Weight313.42 g/mol
Exact Mass313.11
IUPAC Name(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C18H19NO2S/c20-22(21,14-13-15-7-2-1-3-8-15)19-18-12-6-10-16-9-4-5-11-17(16)18/h1-5,7-9,11,13-14,18-19H,6,10,12H2/b14-13+/t18-/m1/s1
InChIKeyMVOJHBQEGYMADK-KAUXGEHWSA-N
XLogP3.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(sulfamoylamino)-1,2,3,4-tetrahydronaphthalene
CID 45117542
N-(1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
CID 4650012
sodium N-(1,2,3,4-tetrahydronaphthalen-1-yl)sulfamate
CID 67463776
N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanesulfonamide
CID 17388085
(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 7202032
N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)methanesulfonamide
CID 71934404
2-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanesulfonamide
CID 79578857
2-fluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 3325789
1,1-dioxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)thietane-3-sulfonamide
CID 126806493
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]formamide
CID 45098245
4-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 43876005
2-methoxy-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanesulfonamide
CID 95733764

Frequently Asked Questions

What is the IUPAC name of (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide?
The IUPAC name of (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide (CID 2375188) is (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide.
What is the SMILES notation for (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide?
The canonical SMILES for (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide is O=S(=O)(/C=C/c1ccccc1)N[C@@H]1CCCc2ccccc21.
What is the InChIKey of (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide?
The InChIKey is MVOJHBQEGYMADK-KAUXGEHWSA-N. The full InChI is InChI=1S/C18H19NO2S/c20-22(21,14-13-15-7-2-1-3-8-15)19-18-12-6-10-16-9-4-5-11-17(16)18/h1-5,7-9,11,13-14,18-19H,6,10,12H2/b14-13+/t18-/m1/s1.
What are the key properties of (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide?
(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide has a molecular weight of 313.42 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide is sourced from PubChem (CID 2375188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).