5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid

C10H9N5O3 — CID 114408305

IUPAC5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid
SMILESNC(=O)c1cnn(-c2nc(C(=O)O)ccc2N)c1
InChIInChI=1S/C10H9N5O3/c11-6-1-2-7(10(17)18)14-9(6)15-4-5(3-13-15)8(12)16/h1-4H,11H2,(H2,12,16)(H,17,18)
InChIKeyAOPNKCROHKDYDP-UHFFFAOYSA-N
MW247.21 g/mol
LogP-0.35
Rot. Bonds3

About 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid

5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid (PubChem CID 114408305) has the molecular formula C10H9N5O3 and a molecular weight of 247.21 g/mol. Its IUPAC name is 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid
PubChem CID114408305
Molecular FormulaC10H9N5O3
Molecular Weight247.21 g/mol
Exact Mass247.07
IUPAC Name5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid
SMILESNC(=O)c1cnn(-c2nc(C(=O)O)ccc2N)c1
InChIInChI=1S/C10H9N5O3/c11-6-1-2-7(10(17)18)14-9(6)15-4-5(3-13-15)8(12)16/h1-4H,11H2,(H2,12,16)(H,17,18)
InChIKeyAOPNKCROHKDYDP-UHFFFAOYSA-N
XLogP-0.35
TPSA137.12 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.21
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-(5,6-diamino-2-pyridinyl)pyrazole-4-carboxamide
CID 79827053
2-(4-carbamoylpyrazol-1-yl)pyridine-3-carboxylic acid
CID 64782904
3-amino-2-(4-carbamoylpyrazol-1-yl)benzoic acid
CID 112579525
2-(4-carbamoylpyrazol-1-yl)quinoline-3-carboxylic acid
CID 64781219
4-(4-carbamoylpyrazol-1-yl)quinoline-2-carboxylic acid
CID 64781969
1-(6-amino-2,3-difluorophenyl)pyrazole-4-carboxamide
CID 64782710
1-(2-amino-5-bromophenyl)pyrazole-4-carboxamide
CID 65342368
5-(4-carbamoylpyrazol-1-yl)furan-2-carboxylic acid
CID 64782902
5-amino-6-(3-propan-2-ylpyrazol-1-yl)pyridine-2-carboxylic acid
CID 114408260
1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)pyrazole-4-carboxamide
CID 80988907
1-(2-amino-5-nitropyrimidin-4-yl)pyrazole-4-carboxamide
CID 114045473
1-(4-carbamothioylpyridazin-3-yl)pyrazole-4-carboxamide
CID 80511607

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid (CID 114408305) is 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid is NC(=O)c1cnn(-c2nc(C(=O)O)ccc2N)c1.
What is the InChIKey of 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid?
The InChIKey is AOPNKCROHKDYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5O3/c11-6-1-2-7(10(17)18)14-9(6)15-4-5(3-13-15)8(12)16/h1-4H,11H2,(H2,12,16)(H,17,18).
What are the key properties of 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid?
5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid has a molecular weight of 247.21 g/mol, XLogP of -0.35, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(4-carbamoylpyrazol-1-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 114408305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).