2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide

C17H14N2O2S — CID 7164103

IUPAC2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C17H14N2O2S/c18-16(21)14-8-9-22-17(14)19-15(20)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H2,18,21)(H,19,20)
InChIKeyWLVZRJYQGCXLLW-UHFFFAOYSA-N
MW310.38 g/mol
LogP3.18
Rot. Bonds4

About 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide

2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide (PubChem CID 7164103) has the molecular formula C17H14N2O2S and a molecular weight of 310.38 g/mol. Its IUPAC name is 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide
PubChem CID7164103
Molecular FormulaC17H14N2O2S
Molecular Weight310.38 g/mol
Exact Mass310.08
IUPAC Name2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C17H14N2O2S/c18-16(21)14-8-9-22-17(14)19-15(20)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H2,18,21)(H,19,20)
InChIKeyWLVZRJYQGCXLLW-UHFFFAOYSA-N
XLogP3.18
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide?
The IUPAC name of 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide (CID 7164103) is 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide is NC(=O)c1ccsc1NC(=O)Cc1cccc2ccccc12.
What is the InChIKey of 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide?
The InChIKey is WLVZRJYQGCXLLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2S/c18-16(21)14-8-9-22-17(14)19-15(20)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H2,18,21)(H,19,20).
What are the key properties of 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide?
2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide has a molecular weight of 310.38 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxamide is sourced from PubChem (CID 7164103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).