N-benzyl-N-ethylthiophene-2-carboxamide

C14H15NOS — CID 668924

IUPACN-benzyl-N-ethylthiophene-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cccs1
InChIInChI=1S/C14H15NOS/c1-2-15(11-12-7-4-3-5-8-12)14(16)13-9-6-10-17-13/h3-10H,2,11H2,1H3
InChIKeySNXLDNIGLODSBL-UHFFFAOYSA-N
MW245.35 g/mol
LogP3.41
Rot. Bonds4

About N-benzyl-N-ethylthiophene-2-carboxamide

N-benzyl-N-ethylthiophene-2-carboxamide (PubChem CID 668924) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is N-benzyl-N-ethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-ethylthiophene-2-carboxamide
PubChem CID668924
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC NameN-benzyl-N-ethylthiophene-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cccs1
InChIInChI=1S/C14H15NOS/c1-2-15(11-12-7-4-3-5-8-12)14(16)13-9-6-10-17-13/h3-10H,2,11H2,1H3
InChIKeySNXLDNIGLODSBL-UHFFFAOYSA-N
XLogP3.41
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethylthiophene-2-carboxamide?
The IUPAC name of N-benzyl-N-ethylthiophene-2-carboxamide (CID 668924) is N-benzyl-N-ethylthiophene-2-carboxamide.
What is the SMILES notation for N-benzyl-N-ethylthiophene-2-carboxamide?
The canonical SMILES for N-benzyl-N-ethylthiophene-2-carboxamide is CCN(Cc1ccccc1)C(=O)c1cccs1.
What is the InChIKey of N-benzyl-N-ethylthiophene-2-carboxamide?
The InChIKey is SNXLDNIGLODSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c1-2-15(11-12-7-4-3-5-8-12)14(16)13-9-6-10-17-13/h3-10H,2,11H2,1H3.
What are the key properties of N-benzyl-N-ethylthiophene-2-carboxamide?
N-benzyl-N-ethylthiophene-2-carboxamide has a molecular weight of 245.35 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethylthiophene-2-carboxamide is sourced from PubChem (CID 668924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).