4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid

C14H14N4O3 — CID 139213286

IUPAC4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid
SMILESCCNC(=O)c1cc(-c2ccc(N)nc2)cc(C(=O)O)n1
InChIInChI=1S/C14H14N4O3/c1-2-16-13(19)10-5-9(6-11(18-10)14(20)21)8-3-4-12(15)17-7-8/h3-7H,2H2,1H3,(H2,15,17)(H,16,19)(H,20,21)
InChIKeyRFUQNLBYDLJCLY-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.17
Rot. Bonds4

About 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid

4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid (PubChem CID 139213286) has the molecular formula C14H14N4O3 and a molecular weight of 286.29 g/mol. Its IUPAC name is 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid
PubChem CID139213286
Molecular FormulaC14H14N4O3
Molecular Weight286.29 g/mol
Exact Mass286.11
IUPAC Name4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid
SMILESCCNC(=O)c1cc(-c2ccc(N)nc2)cc(C(=O)O)n1
InChIInChI=1S/C14H14N4O3/c1-2-16-13(19)10-5-9(6-11(18-10)14(20)21)8-3-4-12(15)17-7-8/h3-7H,2H2,1H3,(H2,15,17)(H,16,19)(H,20,21)
InChIKeyRFUQNLBYDLJCLY-UHFFFAOYSA-N
XLogP1.17
TPSA118.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1,8-Naphthyridine-2-carboxylic acid
CID 735156
4'-[(2-Aminoethyl)carbamoyl]-2,2'-Bipyridine-4-Carboxylic Acid
CID 45377880
6'-amino-4'-ethyl-5'-(4-hydroxyphenyl)-N-methyl-[3,3'-bipyridine]-6-carboxamide
CID 122531750
6-(Pyridin-3-yl)pyrimidine-4-carboxylic acid
CID 57569654
6'-(3-Ethylureido)-[3,3'-bipyridine]-5-carboxylic acid
CID 59208477
5-[6-(Ethylcarbamoylamino)-4-phenyl-3-pyridinyl]pyridine-3-carboxylic acid
CID 59208494
4-[6-(Ethylcarbamoylamino)-3-pyridinyl]benzoic acid
CID 59208509
US11459296, Example 1
CID 146905341
5,6,7,8-Tetrahydro-1,8-naphthyridine-2-carboxylic acid
CID 51358533
5-[6-Amino-5-(4-chlorophenyl)-3-pyridinyl]pyridine-2-carboxylic acid
CID 162677159
3-{[(5-Methylpyridin-2-yl)amino]carbonyl}pyridine-2-carboxylic acid
CID 20866849
2-(Ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 44571955

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid?
The IUPAC name of 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid (CID 139213286) is 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid is CCNC(=O)c1cc(-c2ccc(N)nc2)cc(C(=O)O)n1.
What is the InChIKey of 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid?
The InChIKey is RFUQNLBYDLJCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3/c1-2-16-13(19)10-5-9(6-11(18-10)14(20)21)8-3-4-12(15)17-7-8/h3-7H,2H2,1H3,(H2,15,17)(H,16,19)(H,20,21).
What are the key properties of 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid?
4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 1.17, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-3-pyridinyl)-6-(ethylcarbamoyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 139213286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).