(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide

C19H21NO3S — CID 35547764

IUPAC(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C19H21NO3S/c21-24(22,14-13-16-7-2-1-3-8-16)20-17-9-6-12-19(15-17)23-18-10-4-5-11-18/h1-3,6-9,12-15,18,20H,4-5,10-11H2/b14-13+
InChIKeyLJIRRVAKQICWKR-BUHFOSPRSA-N
MW343.45 g/mol
LogP4.42
Rot. Bonds6

About (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide

(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide (PubChem CID 35547764) has the molecular formula C19H21NO3S and a molecular weight of 343.45 g/mol. Its IUPAC name is (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide.

Molecular Properties

Compound Name(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide
PubChem CID35547764
Molecular FormulaC19H21NO3S
Molecular Weight343.45 g/mol
Exact Mass343.12
IUPAC Name(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C19H21NO3S/c21-24(22,14-13-16-7-2-1-3-8-16)20-17-9-6-12-19(15-17)23-18-10-4-5-11-18/h1-3,6-9,12-15,18,20H,4-5,10-11H2/b14-13+
InChIKeyLJIRRVAKQICWKR-BUHFOSPRSA-N
XLogP4.42
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]cyclopropanecarboxamide
CID 35540858
(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide
CID 43069636
N-(3-cyclopentyloxyphenyl)-3,4-difluorobenzenesulfonamide
CID 35547755
(3-cyclopentyloxyphenyl)hydrazine
CID 55281400
N-(3-methylsulfinylphenyl)-2-phenylethenesulfonamide
CID 72690490
methyl 3-[3-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]prop-2-enoate
CID 67019599
2-(4-fluorophenyl)-N-phenylethenesulfonamide
CID 66810640
3-[3-(2-phenylethenylsulfonylamino)phenyl]prop-2-enoate
CID 4741044
[2-(cyclopentylcarbamoylamino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate
CID 6160338
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
(E)-N-[3-(diethylamino)phenyl]-2-phenylethenesulfonamide
CID 58752965
(Z)-N-cyclohexyl-2-phenylethenesulfonamide
CID 2458985

Frequently Asked Questions

What is the IUPAC name of (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide?
The IUPAC name of (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide (CID 35547764) is (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide.
What is the SMILES notation for (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide?
The canonical SMILES for (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide is O=S(=O)(/C=C/c1ccccc1)Nc1cccc(OC2CCCC2)c1.
What is the InChIKey of (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide?
The InChIKey is LJIRRVAKQICWKR-BUHFOSPRSA-N. The full InChI is InChI=1S/C19H21NO3S/c21-24(22,14-13-16-7-2-1-3-8-16)20-17-9-6-12-19(15-17)23-18-10-4-5-11-18/h1-3,6-9,12-15,18,20H,4-5,10-11H2/b14-13+.
What are the key properties of (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide?
(E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide has a molecular weight of 343.45 g/mol, XLogP of 4.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(3-cyclopentyloxyphenyl)-2-phenylethenesulfonamide is sourced from PubChem (CID 35547764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).