N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide

C15H17NOS — CID 134014370

IUPACN-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(C)cc1
InChIInChI=1S/C15H17NOS/c1-3-16(11-14-5-4-10-18-14)15(17)13-8-6-12(2)7-9-13/h4-10H,3,11H2,1-2H3
InChIKeyJJKFKIRXGVTJOZ-UHFFFAOYSA-N
MW259.37 g/mol
LogP3.72
Rot. Bonds4

About N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide

N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 134014370) has the molecular formula C15H17NOS and a molecular weight of 259.37 g/mol. Its IUPAC name is N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
PubChem CID134014370
Molecular FormulaC15H17NOS
Molecular Weight259.37 g/mol
Exact Mass259.10
IUPAC NameN-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(C)cc1
InChIInChI=1S/C15H17NOS/c1-3-16(11-14-5-4-10-18-14)15(17)13-8-6-12(2)7-9-13/h4-10H,3,11H2,1-2H3
InChIKeyJJKFKIRXGVTJOZ-UHFFFAOYSA-N
XLogP3.72
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.37
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801917
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
4-(difluoromethylsulfanyl)-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 47019958
N-ethyl-2-hydroxy-5-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 60655389
N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 79770274
3,4-diethoxy-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801031
N-ethyl-4-hydrazinyl-3-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 63211798
N-ethyl-4-(4-methyl-2-oxo-1H-imidazol-3-yl)-N-(thiophen-2-ylmethyl)benzamide
CID 47068989
3-amino-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 60940215
3-amino-4-(dimethylamino)-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 61106292
N-ethyl-6-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62175204
N-ethyl-2-hydroxy-3-(4-methylphenyl)-N-(thiophen-2-ylmethyl)butanamide
CID 155945653

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide (CID 134014370) is N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide is CCN(Cc1cccs1)C(=O)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is JJKFKIRXGVTJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NOS/c1-3-16(11-14-5-4-10-18-14)15(17)13-8-6-12(2)7-9-13/h4-10H,3,11H2,1-2H3.
What are the key properties of N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 259.37 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 134014370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).