2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide

C15H18N2OS — CID 62167817

IUPAC2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCCNc1ccccc1C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C15H18N2OS/c1-3-16-14-7-5-4-6-13(14)15(18)17(2)10-12-8-9-19-11-12/h4-9,11,16H,3,10H2,1-2H3
InChIKeyQHOPLFDXZPJFTM-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.45
Rot. Bonds5

About 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide

2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide (PubChem CID 62167817) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide
PubChem CID62167817
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCCNc1ccccc1C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C15H18N2OS/c1-3-16-14-7-5-4-6-13(14)15(18)17(2)10-12-8-9-19-11-12/h4-9,11,16H,3,10H2,1-2H3
InChIKeyQHOPLFDXZPJFTM-UHFFFAOYSA-N
XLogP3.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide (CID 62167817) is 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide is CCNc1ccccc1C(=O)N(C)Cc1ccsc1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The InChIKey is QHOPLFDXZPJFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-3-16-14-7-5-4-6-13(14)15(18)17(2)10-12-8-9-19-11-12/h4-9,11,16H,3,10H2,1-2H3.
What are the key properties of 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide has a molecular weight of 274.39 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide is sourced from PubChem (CID 62167817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).