2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide

C14H10N2O3S — CID 140967202

IUPAC2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide
SMILESNC(=O)n1c(O)c(C(=O)c2cccs2)c2ccccc21
InChIInChI=1S/C14H10N2O3S/c15-14(19)16-9-5-2-1-4-8(9)11(13(16)18)12(17)10-6-3-7-20-10/h1-7,18H,(H2,15,19)
InChIKeyWHPCAEHXYIAIMV-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.57
Rot. Bonds2

About 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide

2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide (PubChem CID 140967202) has the molecular formula C14H10N2O3S and a molecular weight of 286.31 g/mol. Its IUPAC name is 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide
PubChem CID140967202
Molecular FormulaC14H10N2O3S
Molecular Weight286.31 g/mol
Exact Mass286.04
IUPAC Name2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide
SMILESNC(=O)n1c(O)c(C(=O)c2cccs2)c2ccccc21
InChIInChI=1S/C14H10N2O3S/c15-14(19)16-9-5-2-1-4-8(9)11(13(16)18)12(17)10-6-3-7-20-10/h1-7,18H,(H2,15,19)
InChIKeyWHPCAEHXYIAIMV-UHFFFAOYSA-N
XLogP2.57
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide?
The IUPAC name of 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide (CID 140967202) is 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide.
What is the SMILES notation for 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide?
The canonical SMILES for 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide is NC(=O)n1c(O)c(C(=O)c2cccs2)c2ccccc21.
What is the InChIKey of 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide?
The InChIKey is WHPCAEHXYIAIMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3S/c15-14(19)16-9-5-2-1-4-8(9)11(13(16)18)12(17)10-6-3-7-20-10/h1-7,18H,(H2,15,19).
What are the key properties of 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide?
2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide has a molecular weight of 286.31 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide is sourced from PubChem (CID 140967202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).