6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid

C15H11N3O3 — CID 63749854

IUPAC6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
SMILESO=C(Nc1cccc(C(=O)O)n1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H11N3O3/c19-14(10-5-4-9-6-7-16-12(9)8-10)18-13-3-1-2-11(17-13)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19)
InChIKeyBNORTOOHBDSXHW-UHFFFAOYSA-N
MW281.27 g/mol
LogP2.51
Rot. Bonds3

About 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid

6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid (PubChem CID 63749854) has the molecular formula C15H11N3O3 and a molecular weight of 281.27 g/mol. Its IUPAC name is 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
PubChem CID63749854
Molecular FormulaC15H11N3O3
Molecular Weight281.27 g/mol
Exact Mass281.08
IUPAC Name6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
SMILESO=C(Nc1cccc(C(=O)O)n1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H11N3O3/c19-14(10-5-4-9-6-7-16-12(9)8-10)18-13-3-1-2-11(17-13)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19)
InChIKeyBNORTOOHBDSXHW-UHFFFAOYSA-N
XLogP2.51
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
CID 63750401
6-[(4-fluorobenzoyl)amino]pyridine-2-carboxylic acid
CID 63643772
N-(2-chloropyrimidin-4-yl)-1H-indole-6-carboxamide
CID 116795223
N-(1,2-oxazol-3-yl)-1H-indole-6-carboxamide
CID 63768269
6-[(3-hydroxybenzoyl)amino]pyridine-2-carboxylic acid
CID 55249899
N-quinolin-2-yl-1H-indole-5-carboxamide
CID 134151071
N-pyridazin-3-yl-1H-indole-5-carboxamide
CID 115635745
ethane;1H-indole-6-carboxylic acid
CID 142472960
6-[(6-fluoropyridine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 114036709
N-(3-methylsulfanylphenyl)-1H-indole-6-carboxamide
CID 39709233
methyl 4-(1H-indole-6-carbonylamino)benzoate
CID 46460139
N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide
CID 66255832

Frequently Asked Questions

What is the IUPAC name of 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The IUPAC name of 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid (CID 63749854) is 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid is O=C(Nc1cccc(C(=O)O)n1)c1ccc2cc[nH]c2c1.
What is the InChIKey of 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The InChIKey is BNORTOOHBDSXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3/c19-14(10-5-4-9-6-7-16-12(9)8-10)18-13-3-1-2-11(17-13)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19).
What are the key properties of 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid has a molecular weight of 281.27 g/mol, XLogP of 2.51, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid is sourced from PubChem (CID 63749854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).