6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

C11H12N4O2 — CID 114514780

IUPAC6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2ncc(CNC3CC3)cn2n1
InChIInChI=1S/C11H12N4O2/c16-11(17)9-3-10-13-5-7(6-15(10)14-9)4-12-8-1-2-8/h3,5-6,8,12H,1-2,4H2,(H,16,17)
InChIKeyOYWFGSNJHZLJIP-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.68
Rot. Bonds4

About 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid (PubChem CID 114514780) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
PubChem CID114514780
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2ncc(CNC3CC3)cn2n1
InChIInChI=1S/C11H12N4O2/c16-11(17)9-3-10-13-5-7(6-15(10)14-9)4-12-8-1-2-8/h3,5-6,8,12H,1-2,4H2,(H,16,17)
InChIKeyOYWFGSNJHZLJIP-UHFFFAOYSA-N
XLogP0.68
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethyl-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]cyclohexan-1-amine
CID 64739714
5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one
CID 55226100
ethyl 6-(ethylaminomethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
CID 114514786
5-[(cyclopropylamino)methyl]-1-methylimidazole-2-carboxylic acid
CID 117192841
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2-propan-2-ylcyclohexan-1-amine
CID 78926107
2-methyl-2-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]propanamide
CID 55234828
5-[(cyclobutylamino)methyl]pyrazine-2-carboxylic acid
CID 117213219
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 62404768
2-[(cyclopropylamino)methyl]pyrimidine-4-carboxylic acid
CID 84664586
1-(1-ethylpyrrolidin-3-yl)-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]methanamine
CID 62405327
5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
CID 115685055
N-[[2-(azepan-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 55113924

Frequently Asked Questions

What is the IUPAC name of 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The IUPAC name of 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid (CID 114514780) is 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The canonical SMILES for 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid is O=C(O)c1cc2ncc(CNC3CC3)cn2n1.
What is the InChIKey of 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The InChIKey is OYWFGSNJHZLJIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c16-11(17)9-3-10-13-5-7(6-15(10)14-9)4-12-8-1-2-8/h3,5-6,8,12H,1-2,4H2,(H,16,17).
What are the key properties of 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid has a molecular weight of 232.24 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(cyclopropylamino)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 114514780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).