2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide

C13H14N2O2S — CID 67119835

IUPAC2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide
SMILESCCOc1ccccc1-c1cc(C(N)=O)c(N)s1
InChIInChI=1S/C13H14N2O2S/c1-2-17-10-6-4-3-5-8(10)11-7-9(12(14)16)13(15)18-11/h3-7H,2,15H2,1H3,(H2,14,16)
InChIKeyKBVCKDNQRTWJHA-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.49
Rot. Bonds4

About 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide

2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide (PubChem CID 67119835) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide
PubChem CID67119835
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide
SMILESCCOc1ccccc1-c1cc(C(N)=O)c(N)s1
InChIInChI=1S/C13H14N2O2S/c1-2-17-10-6-4-3-5-8(10)11-7-9(12(14)16)13(15)18-11/h3-7H,2,15H2,1H3,(H2,14,16)
InChIKeyKBVCKDNQRTWJHA-UHFFFAOYSA-N
XLogP2.49
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide?
The IUPAC name of 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide (CID 67119835) is 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide?
The canonical SMILES for 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide is CCOc1ccccc1-c1cc(C(N)=O)c(N)s1.
What is the InChIKey of 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide?
The InChIKey is KBVCKDNQRTWJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-2-17-10-6-4-3-5-8(10)11-7-9(12(14)16)13(15)18-11/h3-7H,2,15H2,1H3,(H2,14,16).
What are the key properties of 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide?
2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide has a molecular weight of 262.33 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-ethoxyphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 67119835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).