6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid

C20H17N3O4 — CID 14925426

IUPAC6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid
SMILESCCOc1ccc(NC(=O)c2ccc(-c3ccc(C(=O)O)cn3)nc2)cc1
InChIInChI=1S/C20H17N3O4/c1-2-27-16-7-5-15(6-8-16)23-19(24)13-3-9-17(21-11-13)18-10-4-14(12-22-18)20(25)26/h3-12H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyUBYXPZXRXSCDOB-UHFFFAOYSA-N
MW363.37 g/mol
LogP3.49
Rot. Bonds6

About 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid

6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid (PubChem CID 14925426) has the molecular formula C20H17N3O4 and a molecular weight of 363.37 g/mol. Its IUPAC name is 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid
PubChem CID14925426
Molecular FormulaC20H17N3O4
Molecular Weight363.37 g/mol
Exact Mass363.12
IUPAC Name6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid
SMILESCCOc1ccc(NC(=O)c2ccc(-c3ccc(C(=O)O)cn3)nc2)cc1
InChIInChI=1S/C20H17N3O4/c1-2-27-16-7-5-15(6-8-16)23-19(24)13-3-9-17(21-11-13)18-10-4-14(12-22-18)20(25)26/h3-12H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyUBYXPZXRXSCDOB-UHFFFAOYSA-N
XLogP3.49
TPSA101.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Amg 333
CID 71144018
Ethyl 6-methoxy-4-[4-(4-methylpiperazin-1-yl)anilino]quinoline-3-carboxylate
CID 1272562
4-(5-{[(4-Amino-5-cyano-6-ethoxypyridin-2-yl)formamido]methyl}pyridin-2-yl)benzoic acid
CID 11846287
2-[5-[2-(3-Methoxyphenyl)ethanoylamino]-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567042
6-(2-fluoranylpyridin-4-yl)-~{N}-[(1~{R})-1-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 168276974
6-Ethoxy-4-(3-morpholin-4-yl-propylamino)-quinoline-3-carboxylic acid ethyl ester
CID 16804582
3-{[(4-Ethoxyphenyl)amino]carbonyl}pyridine-2-carboxylic acid
CID 3240810
Acetaminophen nicotinate
CID 3237989
6-[4-(4-fluorophenoxy)phenyl]-N-(2-piperidin-1-ylethyl)pyridine-3-carboxamide
CID 10273574
N,N-Diethyl-6-(spiro[chromene-2,4''-piperidine]-4-yl)nicotinamide
CID 44254061
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-phenylpyridine-3-carboxamide
CID 124156568
2-[[[(3S)-1-[(1R)-1-(4-methoxyphenyl)ethyl]-2-oxopiperidin-3-yl]methylamino]methyl]pyridine-4-carboxylic acid
CID 127034046

Frequently Asked Questions

What is the IUPAC name of 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid?
The IUPAC name of 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid (CID 14925426) is 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid is CCOc1ccc(NC(=O)c2ccc(-c3ccc(C(=O)O)cn3)nc2)cc1.
What is the InChIKey of 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid?
The InChIKey is UBYXPZXRXSCDOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O4/c1-2-27-16-7-5-15(6-8-16)23-19(24)13-3-9-17(21-11-13)18-10-4-14(12-22-18)20(25)26/h3-12H,2H2,1H3,(H,23,24)(H,25,26).
What are the key properties of 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid?
6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid has a molecular weight of 363.37 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 14925426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).