N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide

C12H12N2O2S — CID 34879256

IUPACN-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide
SMILESCCOc1ncccc1NC(=O)c1ccsc1
InChIInChI=1S/C12H12N2O2S/c1-2-16-12-10(4-3-6-13-12)14-11(15)9-5-7-17-8-9/h3-8H,2H2,1H3,(H,14,15)
InChIKeyMNEOEGDLFUZKOZ-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.79
Rot. Bonds4

About N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide

N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide (PubChem CID 34879256) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide
PubChem CID34879256
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC NameN-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide
SMILESCCOc1ncccc1NC(=O)c1ccsc1
InChIInChI=1S/C12H12N2O2S/c1-2-16-12-10(4-3-6-13-12)14-11(15)9-5-7-17-8-9/h3-8H,2H2,1H3,(H,14,15)
InChIKeyMNEOEGDLFUZKOZ-UHFFFAOYSA-N
XLogP2.79
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
CID 63859607
3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958850
6-(dimethylamino)-N-(2-ethoxy-3-pyridinyl)pyridine-3-carboxamide
CID 34955483
2-amino-N-(2-ethoxy-3-pyridinyl)-2-ethylbutanamide
CID 79809690
N-(2-ethoxy-3-pyridinyl)-3-methoxy-4-phenylmethoxybenzamide
CID 34876331
2-bromo-N-(2-ethoxy-3-pyridinyl)-2-methylpropanamide
CID 114327859
1-amino-N-(2-ethoxy-3-pyridinyl)cyclopropane-1-carboxamide
CID 65467015
2-ethoxy-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 2096181
2,5-dibromo-N-(2-ethoxy-3-pyridinyl)benzamide
CID 114371185
N-[2-(ethylaminomethyl)phenyl]thiophene-3-carboxamide
CID 43601345
5-bromo-2-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958257
2-[(2-ethoxy-3-pyridinyl)amino]propanoic acid
CID 66173717

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide (CID 34879256) is N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide is CCOc1ncccc1NC(=O)c1ccsc1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide?
The InChIKey is MNEOEGDLFUZKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-2-16-12-10(4-3-6-13-12)14-11(15)9-5-7-17-8-9/h3-8H,2H2,1H3,(H,14,15).
What are the key properties of N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide?
N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide is sourced from PubChem (CID 34879256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).