2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid

C11H11N3O2 — CID 82078907

IUPAC2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
SMILESCc1cc(C(=O)O)nc2cc(C3CC3)nn12
InChIInChI=1S/C11H11N3O2/c1-6-4-9(11(15)16)12-10-5-8(7-2-3-7)13-14(6)10/h4-5,7H,2-3H2,1H3,(H,15,16)
InChIKeyBUHNQWBCJAFGAO-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.61
Rot. Bonds2

About 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid

2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid (PubChem CID 82078907) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid.

Molecular Properties

Compound Name2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
PubChem CID82078907
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
SMILESCc1cc(C(=O)O)nc2cc(C3CC3)nn12
InChIInChI=1S/C11H11N3O2/c1-6-4-9(11(15)16)12-10-5-8(7-2-3-7)13-14(6)10/h4-5,7H,2-3H2,1H3,(H,15,16)
InChIKeyBUHNQWBCJAFGAO-UHFFFAOYSA-N
XLogP1.61
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,7-dicyclopropylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 71683769
7-methyl-2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82092183
2-amino-1-[(2S)-2-(5-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidin-2-yl)piperidin-1-yl]-2-phenylethanone
CID 58029593
5-(cyclohexylmethyl)-7-methylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 167206058
5-cycloheptyl-7-ethylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 167205842
7-cyclopropyl-2-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 84683520
7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 776256
3-cyclopropyl-1-methylpyrazole-5-carboxylic acid;hydrochloride
CID 133054193
3-cyclopropyl-1-(2,4-dimethylphenyl)pyrazole-5-carboxylic acid
CID 83731165
7-chloro-2-cyclopropyl-5,6-dimethylpyrazolo[1,5-a]pyrimidine
CID 82269862
ethyl 7-amino-2-cyclopropyl-5-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate
CID 58034760
6-cyclohexyl-2-methylpyrimidine-4-carboxylic acid
CID 83822396

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The IUPAC name of 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid (CID 82078907) is 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid.
What is the SMILES notation for 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The canonical SMILES for 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid is Cc1cc(C(=O)O)nc2cc(C3CC3)nn12.
What is the InChIKey of 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The InChIKey is BUHNQWBCJAFGAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-6-4-9(11(15)16)12-10-5-8(7-2-3-7)13-14(6)10/h4-5,7H,2-3H2,1H3,(H,15,16).
What are the key properties of 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid has a molecular weight of 217.23 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid is sourced from PubChem (CID 82078907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).