N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide

C14H11NOS2 — CID 25105719

IUPACN-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1cccc2ccsc12)c1cccs1
InChIInChI=1S/C14H11NOS2/c16-14(12-5-2-7-17-12)15-9-11-4-1-3-10-6-8-18-13(10)11/h1-8H,9H2,(H,15,16)
InChIKeyCFBONDGWZILACS-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.89
Rot. Bonds3

About N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide

N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide (PubChem CID 25105719) has the molecular formula C14H11NOS2 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide
PubChem CID25105719
Molecular FormulaC14H11NOS2
Molecular Weight273.38 g/mol
Exact Mass273.03
IUPAC NameN-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1cccc2ccsc12)c1cccs1
InChIInChI=1S/C14H11NOS2/c16-14(12-5-2-7-17-12)15-9-11-4-1-3-10-6-8-18-13(10)11/h1-8H,9H2,(H,15,16)
InChIKeyCFBONDGWZILACS-UHFFFAOYSA-N
XLogP3.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
CID 2255653
N-(2-Phenylethyl)-2-thiophenecarboxamide
CID 728650
4-[5-(Cyclopropylcarbamoyl)thiophen-2-yl]-1-benzothiophene-2-carboxamide
CID 138857432
N-(thiophen-2-ylmethyl)-1-benzothiophene-3-carboxamide
CID 1247020
N-(2-methoxyethyl)thieno[3,2-b][1]benzothiole-2-carboxamide
CID 1634749
N-[2-(4-fluorophenyl)ethyl]thiophene-2-carboxamide
CID 697434
5-methyl-N-(thiophen-2-ylmethyl)thiophene-3-carboxamide
CID 1247750
N-butyl-1-benzothiophene-2-carboxamide
CID 2054449
5-N-benzyl-2-N-hydroxy-1-benzothiophene-2,5-dicarboxamide
CID 44457032
N-(1-phenylethyl)thiophene-2-carboxamide
CID 2818070
N-(3,3-diphenylpropyl)thiophene-2-carboxamide
CID 673384
N-[(2-fluorophenyl)methyl]thiophene-2-carboxamide
CID 1244199

Frequently Asked Questions

What is the IUPAC name of N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide?
The IUPAC name of N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide (CID 25105719) is N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide is O=C(NCc1cccc2ccsc12)c1cccs1.
What is the InChIKey of N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide?
The InChIKey is CFBONDGWZILACS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NOS2/c16-14(12-5-2-7-17-12)15-9-11-4-1-3-10-6-8-18-13(10)11/h1-8H,9H2,(H,15,16).
What are the key properties of N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide?
N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide has a molecular weight of 273.38 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzothiophen-7-ylmethyl)thiophene-2-carboxamide is sourced from PubChem (CID 25105719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).