6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid

C15H14N2O4 — CID 61236807

IUPAC6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C(=O)Nc2ccc(CCO)cc2)nc1
InChIInChI=1S/C15H14N2O4/c18-8-7-10-1-4-12(5-2-10)17-14(19)13-6-3-11(9-16-13)15(20)21/h1-6,9,18H,7-8H2,(H,17,19)(H,20,21)
InChIKeyCWIDVJHJYGHZCK-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.57
Rot. Bonds5

About 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid

6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid (PubChem CID 61236807) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid
PubChem CID61236807
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C(=O)Nc2ccc(CCO)cc2)nc1
InChIInChI=1S/C15H14N2O4/c18-8-7-10-1-4-12(5-2-10)17-14(19)13-6-3-11(9-16-13)15(20)21/h1-6,9,18H,7-8H2,(H,17,19)(H,20,21)
InChIKeyCWIDVJHJYGHZCK-UHFFFAOYSA-N
XLogP1.57
TPSA99.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 104642279
6-[(4-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43427214
N-[4-(2-hydroxyethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 51985113
6-[(4-ethoxyphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43427210
5,6-dichloro-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
CID 51985204
N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 61223962
N-[4-(2-hydroxyethyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 61221260
6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
CID 61237341
6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
CID 62181500
N-[4-(2-hydroxyethyl)phenyl]pyrimidine-5-carboxamide
CID 104627400
6-amino-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
CID 55041891
4-(2-hydroxyethyl)benzoic acid
CID 506062

Frequently Asked Questions

What is the IUPAC name of 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid?
The IUPAC name of 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid (CID 61236807) is 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid is O=C(O)c1ccc(C(=O)Nc2ccc(CCO)cc2)nc1.
What is the InChIKey of 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid?
The InChIKey is CWIDVJHJYGHZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c18-8-7-10-1-4-12(5-2-10)17-14(19)13-6-3-11(9-16-13)15(20)21/h1-6,9,18H,7-8H2,(H,17,19)(H,20,21).
What are the key properties of 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid?
6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 1.57, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 61236807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).