N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide

C14H15NOS — CID 532899

IUPACN-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide
SMILESCCN(C(=O)c1cccs1)c1cccc(C)c1
InChIInChI=1S/C14H15NOS/c1-3-15(12-7-4-6-11(2)10-12)14(16)13-8-5-9-17-13/h4-10H,3H2,1-2H3
InChIKeyYFJNAIMKFSZOKA-UHFFFAOYSA-N
MW245.35 g/mol
LogP3.72
Rot. Bonds3

About N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide

N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide (PubChem CID 532899) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide
PubChem CID532899
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC NameN-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide
SMILESCCN(C(=O)c1cccs1)c1cccc(C)c1
InChIInChI=1S/C14H15NOS/c1-3-15(12-7-4-6-11(2)10-12)14(16)13-8-5-9-17-13/h4-10H,3H2,1-2H3
InChIKeyYFJNAIMKFSZOKA-UHFFFAOYSA-N
XLogP3.72
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide (CID 532899) is N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide is CCN(C(=O)c1cccs1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide?
The InChIKey is YFJNAIMKFSZOKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c1-3-15(12-7-4-6-11(2)10-12)14(16)13-8-5-9-17-13/h4-10H,3H2,1-2H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide?
N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide has a molecular weight of 245.35 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 532899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).