2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide

C15H16N2O2S — CID 138992966

IUPAC2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)[nH]c(=O)c1)c1ccsc1
InChIInChI=1S/C15H16N2O2S/c1-9(11-4-5-20-8-11)16-15(19)12-6-13(10-2-3-10)17-14(18)7-12/h4-10H,2-3H2,1H3,(H,16,19)(H,17,18)
InChIKeyOVIQWTYAWKVZLV-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.80
Rot. Bonds4

About 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide

2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide (PubChem CID 138992966) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide
PubChem CID138992966
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)[nH]c(=O)c1)c1ccsc1
InChIInChI=1S/C15H16N2O2S/c1-9(11-4-5-20-8-11)16-15(19)12-6-13(10-2-3-10)17-14(18)7-12/h4-10H,2-3H2,1H3,(H,16,19)(H,17,18)
InChIKeyOVIQWTYAWKVZLV-UHFFFAOYSA-N
XLogP2.80
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(1-thiophen-3-ylethyl)thiophene-3-carboxamide
CID 55209412
2-cyclopropyl-4-(1-thiophen-3-ylethylamino)-1H-pyrimidin-6-one
CID 136975504
2-cyclopropyl-N-[1-(4-fluorophenyl)butan-2-yl]-6-oxo-1H-pyridine-4-carboxamide
CID 154842797
3-amino-5-methoxy-N-(1-thiophen-3-ylethyl)benzamide
CID 81091006
4-(bromomethyl)-N-(1-thiophen-3-ylethyl)benzamide
CID 102851621
3-amino-4-chloro-N-(1-thiophen-3-ylethyl)benzamide
CID 62840598
2-amino-N-(1-thiophen-3-ylethyl)cyclopentane-1-carboxamide
CID 64824650
6-amino-5-chloro-N-(1-thiophen-3-ylethyl)pyridine-3-carboxamide
CID 62842868
6-(2-methylpropyl)-2-oxo-N-(1-thiophen-3-ylethyl)-1H-pyrimidine-4-carboxamide
CID 131918411
1-hydroxy-3-(1-thiophen-3-ylethyl)urea
CID 23821299
N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide
CID 62842811
4-amino-1-methyl-N-(1-thiophen-3-ylethyl)pyrrole-2-carboxamide
CID 62841289

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide (CID 138992966) is 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide is CC(NC(=O)c1cc(C2CC2)[nH]c(=O)c1)c1ccsc1.
What is the InChIKey of 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide?
The InChIKey is OVIQWTYAWKVZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-9(11-4-5-20-8-11)16-15(19)12-6-13(10-2-3-10)17-14(18)7-12/h4-10H,2-3H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide?
2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide has a molecular weight of 288.37 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-oxo-N-(1-thiophen-3-ylethyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 138992966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).