N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide

C15H15NO2S — CID 110681350

IUPACN-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2CC2c2cccs2)cc1
InChIInChI=1S/C15H15NO2S/c1-18-11-6-4-10(5-7-11)16-15(17)13-9-12(13)14-3-2-8-19-14/h2-8,12-13H,9H2,1H3,(H,16,17)
InChIKeyVKHUKEZPEVSPPR-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.50
Rot. Bonds4

About N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide

N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide (PubChem CID 110681350) has the molecular formula C15H15NO2S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide
PubChem CID110681350
Molecular FormulaC15H15NO2S
Molecular Weight273.36 g/mol
Exact Mass273.08
IUPAC NameN-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2CC2c2cccs2)cc1
InChIInChI=1S/C15H15NO2S/c1-18-11-6-4-10(5-7-11)16-15(17)13-9-12(13)14-3-2-8-19-14/h2-8,12-13H,9H2,1H3,(H,16,17)
InChIKeyVKHUKEZPEVSPPR-UHFFFAOYSA-N
XLogP3.50
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(4-chlorophenyl)sulfonylphenyl]-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 139582978
N-(2-methoxyethyl)-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 110681278
2-[(4-methoxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 53270389
N-(3-cyanophenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 110681378
2-N-(4-methoxyphenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109140939
N-cyclopropyl-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 110681267
N-[(2-methoxyphenyl)methyl]-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 110681294
1-N-(2-chlorophenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142814
2-(4-methoxyphenyl)-1-[4-[(1S,2R)-2-thiophen-2-ylcyclopropanecarbonyl]piperazin-1-yl]ethanone
CID 51897971
1-N-(2-ethylphenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142010
(4S)-N-(4-methoxyphenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 695933
(1R,2R)-N-(4-methoxyphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 100939210

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide (CID 110681350) is N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide is COc1ccc(NC(=O)C2CC2c2cccs2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide?
The InChIKey is VKHUKEZPEVSPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2S/c1-18-11-6-4-10(5-7-11)16-15(17)13-9-12(13)14-3-2-8-19-14/h2-8,12-13H,9H2,1H3,(H,16,17).
What are the key properties of N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide?
N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide has a molecular weight of 273.36 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-thiophen-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 110681350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).