4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid

C15H11N3O3 — CID 63750401

IUPAC4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
SMILESO=C(Nc1ccnc(C(=O)O)c1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H11N3O3/c19-14(10-2-1-9-3-5-16-12(9)7-10)18-11-4-6-17-13(8-11)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19)
InChIKeyDSUYWPQSFBAHRV-UHFFFAOYSA-N
MW281.27 g/mol
LogP2.51
Rot. Bonds3

About 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid

4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid (PubChem CID 63750401) has the molecular formula C15H11N3O3 and a molecular weight of 281.27 g/mol. Its IUPAC name is 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
PubChem CID63750401
Molecular FormulaC15H11N3O3
Molecular Weight281.27 g/mol
Exact Mass281.08
IUPAC Name4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
SMILESO=C(Nc1ccnc(C(=O)O)c1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H11N3O3/c19-14(10-2-1-9-3-5-16-12(9)7-10)18-11-4-6-17-13(8-11)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19)
InChIKeyDSUYWPQSFBAHRV-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

6-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid
CID 63749854
4-(pyridine-4-carbonylamino)pyridine-2-carboxylic acid
CID 63651530
N-(2-chloropyrimidin-4-yl)-1H-indole-6-carboxamide
CID 116795223
N-(2H-benzotriazol-5-yl)-1H-indole-6-carboxamide
CID 71918413
N-(1,2-oxazol-3-yl)-1H-indole-6-carboxamide
CID 63768269
4-[(3-nitrobenzoyl)amino]pyridine-2-carboxylic acid
CID 63651069
N-(3-methylsulfanylphenyl)-1H-indole-6-carboxamide
CID 39709233
4-[(3,5-dimethylbenzoyl)amino]pyridine-2-carboxylic acid
CID 63651310
methyl 4-(1H-indole-6-carbonylamino)benzoate
CID 46460139
4-[[3-(dimethylamino)benzoyl]amino]pyridine-2-carboxylic acid
CID 63651857
N-[3-(dimethylcarbamoylamino)phenyl]-1H-indole-6-carboxamide
CID 167796814
N-(2-methyl-3H-benzimidazol-5-yl)-1H-indole-6-carboxamide
CID 110205491

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The IUPAC name of 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid (CID 63750401) is 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid is O=C(Nc1ccnc(C(=O)O)c1)c1ccc2cc[nH]c2c1.
What is the InChIKey of 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
The InChIKey is DSUYWPQSFBAHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3/c19-14(10-2-1-9-3-5-16-12(9)7-10)18-11-4-6-17-13(8-11)15(20)21/h1-8,16H,(H,20,21)(H,17,18,19).
What are the key properties of 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid?
4-(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 4-(1H-indole-6-carbonylamino)pyridine-2-carboxylic acid is sourced from PubChem (CID 63750401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).