2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine

C12H16N4 — CID 84784857

IUPAC2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cc2ncc(CC3CCCN3)cn2n1
InChIInChI=1S/C12H16N4/c1-9-5-12-14-7-10(8-16(12)15-9)6-11-3-2-4-13-11/h5,7-8,11,13H,2-4,6H2,1H3
InChIKeySZMDABNHRKSRAK-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.33
Rot. Bonds2

About 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine

2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 84784857) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID84784857
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cc2ncc(CC3CCCN3)cn2n1
InChIInChI=1S/C12H16N4/c1-9-5-12-14-7-10(8-16(12)15-9)6-11-3-2-4-13-11/h5,7-8,11,13H,2-4,6H2,1H3
InChIKeySZMDABNHRKSRAK-UHFFFAOYSA-N
XLogP1.33
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethyl-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]cyclohexan-1-amine
CID 64739714
1-tert-butyl-4-(pyrrolidin-2-ylmethyl)pyrazole
CID 84734214
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2-propan-2-ylcyclohexan-1-amine
CID 78926107
1-propyl-4-(pyrrolidin-2-ylmethyl)pyrazole
CID 103573721
2-[(3,4,5-trimethylphenyl)methyl]pyrrolidine
CID 117292011
4-methyl-2-[3-(pyrrolidin-2-ylmethyl)phenyl]triazole
CID 117358210
5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one
CID 55226100
1,5-dimethyl-3-(pyrrolidin-2-ylmethyl)pyrazole
CID 82600329
2-[(1-ethylpyrazol-4-yl)methyl]piperidine
CID 62232960
2-[(4-methylphenyl)methyl]pyrrolidine
CID 3510571
N,N-dimethyl-1-[[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]methyl]cyclobutan-1-amine
CID 105414494
2-[(1-methylimidazol-4-yl)methyl]piperidine
CID 130509272

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine (CID 84784857) is 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine is Cc1cc2ncc(CC3CCCN3)cn2n1.
What is the InChIKey of 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is SZMDABNHRKSRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-5-12-14-7-10(8-16(12)15-9)6-11-3-2-4-13-11/h5,7-8,11,13H,2-4,6H2,1H3.
What are the key properties of 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine?
2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 216.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 84784857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).