5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid

C10H10N4O2 — CID 135371375

IUPAC5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
SMILESCc1nn(-c2ccccn2)c(N)c1C(=O)O
InChIInChI=1S/C10H10N4O2/c1-6-8(10(15)16)9(11)14(13-6)7-4-2-3-5-12-7/h2-5H,11H2,1H3,(H,15,16)
InChIKeySJVVUPXWGAXBDS-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.86
Rot. Bonds2

About 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid

5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid (PubChem CID 135371375) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid.

Molecular Properties

Compound Name5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
PubChem CID135371375
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
SMILESCc1nn(-c2ccccn2)c(N)c1C(=O)O
InChIInChI=1S/C10H10N4O2/c1-6-8(10(15)16)9(11)14(13-6)7-4-2-3-5-12-7/h2-5H,11H2,1H3,(H,15,16)
InChIKeySJVVUPXWGAXBDS-UHFFFAOYSA-N
XLogP0.86
TPSA94.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-3-(4-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 54553606
5-amino-1-(2-fluorophenyl)-3-methylpyrazole-4-carboxylic acid
CID 71044411
(Z)-3-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)-4-hydroxypent-3-en-2-one
CID 102202777
5-(4-ethoxyphenyl)-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
CID 82072302
triphenylstannyl 3,5-dimethyl-1-pyridin-2-ylpyrazole-4-carboxylate
CID 141206427
5-chloro-3-cyclopropyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
CID 55189272
1-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethane-1,2-dione
CID 51260305
3-(5-amino-3-methyl-1-pyridin-2-ylpyrazol-4-yl)-3-hydroxy-1-methylindol-2-one
CID 166988820
methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate
CID 86250027
5-amino-1-(4-fluoro-2-methylphenyl)-3-methylpyrazole-4-carboxylic acid
CID 153408760
3,5-dimethyl-1-pyridin-2-ylpyrazole-4-thiol
CID 97179619
4-[(4R)-3-methyl-7-oxo-1-pyridin-2-yl-4,8-dihydropyrazolo[5,4-e][1,4]thiazepin-4-yl]benzoic acid
CID 136667117

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid?
The IUPAC name of 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid (CID 135371375) is 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid.
What is the SMILES notation for 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid?
The canonical SMILES for 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid is Cc1nn(-c2ccccn2)c(N)c1C(=O)O.
What is the InChIKey of 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid?
The InChIKey is SJVVUPXWGAXBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-6-8(10(15)16)9(11)14(13-6)7-4-2-3-5-12-7/h2-5H,11H2,1H3,(H,15,16).
What are the key properties of 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid?
5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid has a molecular weight of 218.22 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid is sourced from PubChem (CID 135371375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).