6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

C8H8N4O2 — CID 114514794

IUPAC6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
SMILESNCc1cnc2c(C(=O)O)cnn2c1
InChIInChI=1S/C8H8N4O2/c9-1-5-2-10-7-6(8(13)14)3-11-12(7)4-5/h2-4H,1,9H2,(H,13,14)
InChIKeyWTMAOILBCGYZSC-UHFFFAOYSA-N
MW192.18 g/mol
LogP-0.11
Rot. Bonds2

About 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid (PubChem CID 114514794) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid.

Molecular Properties

Compound Name6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
PubChem CID114514794
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
SMILESNCc1cnc2c(C(=O)O)cnn2c1
InChIInChI=1S/C8H8N4O2/c9-1-5-2-10-7-6(8(13)14)3-11-12(7)4-5/h2-4H,1,9H2,(H,13,14)
InChIKeyWTMAOILBCGYZSC-UHFFFAOYSA-N
XLogP-0.11
TPSA93.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 112706669
6-(3-hydroxypropyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 58056251
6-tert-butylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 83917493
6-[(3-chloro-4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 59822824
6-[[methyl-[2-(1-methylpyrazol-4-yl)ethyl]amino]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 74243849
6-methylsulfonylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 146100718
6-[[methyl-[(3-methyloxetan-3-yl)methyl]amino]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 122561032
6-(diethylaminomethyl)-N,N-diethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56702378
6-[[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 91839921
6-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethylamino)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167882445
2-[4-(aminomethyl)pyrazol-1-yl]pyridine-3-carboxylic acid
CID 84785993
5-(aminomethyl)pyrimidine-2-carboxylic acid
CID 45082082

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The IUPAC name of 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid (CID 114514794) is 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid.
What is the SMILES notation for 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The canonical SMILES for 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid is NCc1cnc2c(C(=O)O)cnn2c1.
What is the InChIKey of 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The InChIKey is WTMAOILBCGYZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c9-1-5-2-10-7-6(8(13)14)3-11-12(7)4-5/h2-4H,1,9H2,(H,13,14).
What are the key properties of 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid has a molecular weight of 192.18 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid is sourced from PubChem (CID 114514794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).