N-naphthalen-1-ylthiophene-2-carboxamide

C15H11NOS — CID 531930

IUPACN-naphthalen-1-ylthiophene-2-carboxamide
SMILESO=C(Nc1cccc2ccccc12)c1cccs1
InChIInChI=1S/C15H11NOS/c17-15(14-9-4-10-18-14)16-13-8-3-6-11-5-1-2-7-12(11)13/h1-10H,(H,16,17)
InChIKeyAKWLMJIIXUBZSM-UHFFFAOYSA-N
MW253.33 g/mol
LogP4.15
Rot. Bonds2

About N-naphthalen-1-ylthiophene-2-carboxamide

N-naphthalen-1-ylthiophene-2-carboxamide (PubChem CID 531930) has the molecular formula C15H11NOS and a molecular weight of 253.33 g/mol. Its IUPAC name is N-naphthalen-1-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-naphthalen-1-ylthiophene-2-carboxamide
PubChem CID531930
Molecular FormulaC15H11NOS
Molecular Weight253.33 g/mol
Exact Mass253.06
IUPAC NameN-naphthalen-1-ylthiophene-2-carboxamide
SMILESO=C(Nc1cccc2ccccc12)c1cccs1
InChIInChI=1S/C15H11NOS/c17-15(14-9-4-10-18-14)16-13-8-3-6-11-5-1-2-7-12(11)13/h1-10H,(H,16,17)
InChIKeyAKWLMJIIXUBZSM-UHFFFAOYSA-N
XLogP4.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-ylthiophene-2-carboxamide?
The IUPAC name of N-naphthalen-1-ylthiophene-2-carboxamide (CID 531930) is N-naphthalen-1-ylthiophene-2-carboxamide.
What is the SMILES notation for N-naphthalen-1-ylthiophene-2-carboxamide?
The canonical SMILES for N-naphthalen-1-ylthiophene-2-carboxamide is O=C(Nc1cccc2ccccc12)c1cccs1.
What is the InChIKey of N-naphthalen-1-ylthiophene-2-carboxamide?
The InChIKey is AKWLMJIIXUBZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NOS/c17-15(14-9-4-10-18-14)16-13-8-3-6-11-5-1-2-7-12(11)13/h1-10H,(H,16,17).
What are the key properties of N-naphthalen-1-ylthiophene-2-carboxamide?
N-naphthalen-1-ylthiophene-2-carboxamide has a molecular weight of 253.33 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-ylthiophene-2-carboxamide is sourced from PubChem (CID 531930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).