4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide

C19H21NO2S — CID 39100305

IUPAC4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide
SMILESCSc1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C19H21NO2S/c1-23-18-12-8-15(9-13-18)20-19(21)14-6-10-17(11-7-14)22-16-4-2-3-5-16/h6-13,16H,2-5H2,1H3,(H,20,21)
InChIKeyMXSCYWJGJVKGOR-UHFFFAOYSA-N
MW327.45 g/mol
LogP4.98
Rot. Bonds5

About 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide

4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide (PubChem CID 39100305) has the molecular formula C19H21NO2S and a molecular weight of 327.45 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide
PubChem CID39100305
Molecular FormulaC19H21NO2S
Molecular Weight327.45 g/mol
Exact Mass327.13
IUPAC Name4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide
SMILESCSc1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C19H21NO2S/c1-23-18-12-8-15(9-13-18)20-19(21)14-6-10-17(11-7-14)22-16-4-2-3-5-16/h6-13,16H,2-5H2,1H3,(H,20,21)
InChIKeyMXSCYWJGJVKGOR-UHFFFAOYSA-N
XLogP4.98
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
N-(4-cyclopentyloxyphenyl)-4-(methylsulfamoyl)benzamide
CID 38455287
N-(4-cyclopentyloxyphenyl)pyridine-4-carboxamide;hydrochloride
CID 110777040
N-(4-cyclopentyloxyphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 36566720
4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
CID 55606378
4-methylsulfanyl-N-[4-[[4-[(4-methylsulfanylbenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 43980966
N-[2-(4-cyclopentyloxyanilino)-2-oxoethyl]-4-fluorobenzamide
CID 38455253
N-(4-iodophenyl)-4-methylsulfanylbenzamide
CID 8571979
N-ethyl-4-[(4-methylsulfanylbenzoyl)amino]benzamide
CID 78892378
4-cyclohexyloxy-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 75424608
N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 46775326
N-[4-(cycloheptylamino)phenyl]-4-methoxybenzamide
CID 112984992

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide?
The IUPAC name of 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide (CID 39100305) is 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide?
The canonical SMILES for 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide is CSc1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide?
The InChIKey is MXSCYWJGJVKGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2S/c1-23-18-12-8-15(9-13-18)20-19(21)14-6-10-17(11-7-14)22-16-4-2-3-5-16/h6-13,16H,2-5H2,1H3,(H,20,21).
What are the key properties of 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide?
4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide has a molecular weight of 327.45 g/mol, XLogP of 4.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide is sourced from PubChem (CID 39100305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).