3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid

C15H14N2O4 — CID 3240810

IUPAC3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
SMILESCCOc1ccc(NC(=O)c2cccnc2C(=O)O)cc1
InChIInChI=1S/C15H14N2O4/c1-2-21-11-7-5-10(6-8-11)17-14(18)12-4-3-9-16-13(12)15(19)20/h3-9H,2H2,1H3,(H,17,18)(H,19,20)
InChIKeyIUZFNMDVEXELOI-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.43
Rot. Bonds5

About 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid

3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid (PubChem CID 3240810) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
PubChem CID3240810
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
SMILESCCOc1ccc(NC(=O)c2cccnc2C(=O)O)cc1
InChIInChI=1S/C15H14N2O4/c1-2-21-11-7-5-10(6-8-11)17-14(18)12-4-3-9-16-13(12)15(19)20/h3-9H,2H2,1H3,(H,17,18)(H,19,20)
InChIKeyIUZFNMDVEXELOI-UHFFFAOYSA-N
XLogP2.43
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(6-phenoxypyridine-3-carbonyl)-L-leucine
CID 153835401
6-(4-methoxyphenyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
CID 682662
N-(4-Ethoxyphenyl)picolinamide
CID 904031
N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 532821
[2-[2-(4-Methoxyphenyl)ethylamino]-2-oxoethyl] pyridine-2-carboxylate
CID 2363580
Methyl 3-[(4-methoxyphenyl)carbamoyl]pyridine-4-carboxylate
CID 2764383
2-({[2-(4-Methylphenoxy)pyridin-3-yl]carbonyl}amino)acetic acid
CID 2801072
6-(4-ethoxyphenyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
CID 3237849
Acetaminophen nicotinate
CID 3237989
Methyl 4-[[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]carbamoyl]benzoate
CID 124156082
5-[[3-(Cyclohexene-1-carbonylamino)phenyl]methoxy]pyridine-3-carboxamide
CID 124156920
Sortilin antagonist 1
CID 162653277

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid?
The IUPAC name of 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid (CID 3240810) is 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid?
The canonical SMILES for 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid is CCOc1ccc(NC(=O)c2cccnc2C(=O)O)cc1.
What is the InChIKey of 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid?
The InChIKey is IUZFNMDVEXELOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-2-21-11-7-5-10(6-8-11)17-14(18)12-4-3-9-16-13(12)15(19)20/h3-9H,2H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid?
3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethoxyphenyl)carbamoyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 3240810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).