3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide

C15H15NO2S — CID 110711234

IUPAC3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide
SMILESCOc1cccc(C(=O)NC2CC2c2cccs2)c1
InChIInChI=1S/C15H15NO2S/c1-18-11-5-2-4-10(8-11)15(17)16-13-9-12(13)14-6-3-7-19-14/h2-8,12-13H,9H2,1H3,(H,16,17)
InChIKeyVVZQTUPULNRBER-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.04
Rot. Bonds4

About 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide

3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide (PubChem CID 110711234) has the molecular formula C15H15NO2S and a molecular weight of 273.36 g/mol. Its IUPAC name is 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide
PubChem CID110711234
Molecular FormulaC15H15NO2S
Molecular Weight273.36 g/mol
Exact Mass273.08
IUPAC Name3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide
SMILESCOc1cccc(C(=O)NC2CC2c2cccs2)c1
InChIInChI=1S/C15H15NO2S/c1-18-11-5-2-4-10(8-11)15(17)16-13-9-12(13)14-6-3-7-19-14/h2-8,12-13H,9H2,1H3,(H,16,17)
InChIKeyVVZQTUPULNRBER-UHFFFAOYSA-N
XLogP3.04
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 ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(2-thiophen-2-ylcyclopropyl)benzamide
CID 110711228
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-methoxy-N-(4-methylpyrrolidin-3-yl)benzamide
CID 113457504
N-(2-bromocyclopentyl)-3-methoxybenzamide
CID 80662437
N-(2-tert-butylcyclohexyl)-3-methoxybenzamide
CID 17146888
3-methoxy-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918037
N-(3-cyanopiperidin-4-yl)-3-methoxybenzamide;hydrochloride
CID 140694639
methyl 4-[(3-methoxybenzoyl)amino]cyclohexane-1-carboxylate
CID 115617221
N-[2-[(dimethylamino)methyl]cyclohexyl]-3-methoxybenzamide
CID 110279269
N-(4-cyanocyclohexyl)-3-methoxybenzamide
CID 115270167
3-methoxy-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)benzamide
CID 4527013
3-methoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]benzamide
CID 8820699

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide?
The IUPAC name of 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide (CID 110711234) is 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide.
What is the SMILES notation for 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide?
The canonical SMILES for 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide is COc1cccc(C(=O)NC2CC2c2cccs2)c1.
What is the InChIKey of 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide?
The InChIKey is VVZQTUPULNRBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2S/c1-18-11-5-2-4-10(8-11)15(17)16-13-9-12(13)14-6-3-7-19-14/h2-8,12-13H,9H2,1H3,(H,16,17).
What are the key properties of 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide?
3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide has a molecular weight of 273.36 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide is sourced from PubChem (CID 110711234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).