N-cyclohexyl-4-thiophen-3-ylbenzamide

C17H19NOS — CID 20974786

IUPACN-cyclohexyl-4-thiophen-3-ylbenzamide
SMILESO=C(NC1CCCCC1)c1ccc(-c2ccsc2)cc1
InChIInChI=1S/C17H19NOS/c19-17(18-16-4-2-1-3-5-16)14-8-6-13(7-9-14)15-10-11-20-12-15/h6-12,16H,1-5H2,(H,18,19)
InChIKeyLIRHSMJZWNERNG-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.48
Rot. Bonds3

About N-cyclohexyl-4-thiophen-3-ylbenzamide

N-cyclohexyl-4-thiophen-3-ylbenzamide (PubChem CID 20974786) has the molecular formula C17H19NOS and a molecular weight of 285.41 g/mol. Its IUPAC name is N-cyclohexyl-4-thiophen-3-ylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-thiophen-3-ylbenzamide
PubChem CID20974786
Molecular FormulaC17H19NOS
Molecular Weight285.41 g/mol
Exact Mass285.12
IUPAC NameN-cyclohexyl-4-thiophen-3-ylbenzamide
SMILESO=C(NC1CCCCC1)c1ccc(-c2ccsc2)cc1
InChIInChI=1S/C17H19NOS/c19-17(18-16-4-2-1-3-5-16)14-8-6-13(7-9-14)15-10-11-20-12-15/h6-12,16H,1-5H2,(H,18,19)
InChIKeyLIRHSMJZWNERNG-UHFFFAOYSA-N
XLogP4.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-4-thiophen-3-ylbenzamide
CID 20974787
N-(2-cyclohexyl-2-hydroxyethyl)-4-thiophen-3-ylbenzamide
CID 91624535
N-cyclooctyl-4-methylbenzamide
CID 3995245
N-[1-(1,2,5-thiadiazol-3-yl)piperidin-4-yl]-4-thiophen-3-ylbenzamide
CID 131702121
N-cyclohexyl-4-thiophen-2-ylbenzamide
CID 4861985
4-bromo-N-cycloheptylbenzamide
CID 2843132
4-bromo-N-cyclooctylbenzamide
CID 902872
3-amino-N-cyclopropyl-4-thiophen-3-ylbenzamide
CID 126538925
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043
N-cyclopentyl-4-sulfanylbenzamide
CID 71194494
N-cyclobutyl-4-methylbenzamide
CID 23530676
N-cycloheptyl-4-(methylamino)benzamide
CID 62165627

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-thiophen-3-ylbenzamide?
The IUPAC name of N-cyclohexyl-4-thiophen-3-ylbenzamide (CID 20974786) is N-cyclohexyl-4-thiophen-3-ylbenzamide.
What is the SMILES notation for N-cyclohexyl-4-thiophen-3-ylbenzamide?
The canonical SMILES for N-cyclohexyl-4-thiophen-3-ylbenzamide is O=C(NC1CCCCC1)c1ccc(-c2ccsc2)cc1.
What is the InChIKey of N-cyclohexyl-4-thiophen-3-ylbenzamide?
The InChIKey is LIRHSMJZWNERNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NOS/c19-17(18-16-4-2-1-3-5-16)14-8-6-13(7-9-14)15-10-11-20-12-15/h6-12,16H,1-5H2,(H,18,19).
What are the key properties of N-cyclohexyl-4-thiophen-3-ylbenzamide?
N-cyclohexyl-4-thiophen-3-ylbenzamide has a molecular weight of 285.41 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-thiophen-3-ylbenzamide is sourced from PubChem (CID 20974786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).