3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine

C11H16N4 — CID 83882052

IUPAC3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine
SMILESCC(C)C(CN)c1cc2ncccn2n1
InChIInChI=1S/C11H16N4/c1-8(2)9(7-12)10-6-11-13-4-3-5-15(11)14-10/h3-6,8-9H,7,12H2,1-2H3
InChIKeyDEUNEFJGZYBJKZ-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.43
Rot. Bonds3

About 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine

3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine (PubChem CID 83882052) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine.

Molecular Properties

Compound Name3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine
PubChem CID83882052
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine
SMILESCC(C)C(CN)c1cc2ncccn2n1
InChIInChI=1S/C11H16N4/c1-8(2)9(7-12)10-6-11-13-4-3-5-15(11)14-10/h3-6,8-9H,7,12H2,1-2H3
InChIKeyDEUNEFJGZYBJKZ-UHFFFAOYSA-N
XLogP1.43
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-propan-2-ylpyrazolo[1,5-a]pyrimidine
CID 59747998
(2R)-3-methyl-2-pyridin-2-ylbutan-1-amine
CID 96736561
2-(chloromethyl)pyrazolo[1,5-a]pyrimidine
CID 177037007
6-(1-pyrazolo[1,5-a]pyrimidin-2-ylhexyl)quinoline
CID 142202676
2-ethenylpyrazolo[1,5-a]pyrimidine
CID 19807212
2-(2-propan-2-ylpyrazolo[1,5-a]pyrimidin-6-yl)acetic acid
CID 84786594
2-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 91408031
carbamoyl pyrazolo[1,5-a]pyrimidine-2-carboxylate
CID 140778817
2-([1,2,4]triazolo[1,5-a]pyridin-2-yl)propan-1-amine
CID 116989368
2-pyrazin-2-ylpyrazolo[1,5-a]pyrimidine
CID 175830982
N-[2-(2-methylpropylsulfonyl)ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 74242766
3-methyl-2-quinolin-8-ylbutan-1-amine
CID 83886423

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine?
The IUPAC name of 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine (CID 83882052) is 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine.
What is the SMILES notation for 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine?
The canonical SMILES for 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine is CC(C)C(CN)c1cc2ncccn2n1.
What is the InChIKey of 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine?
The InChIKey is DEUNEFJGZYBJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-8(2)9(7-12)10-6-11-13-4-3-5-15(11)14-10/h3-6,8-9H,7,12H2,1-2H3.
What are the key properties of 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine?
3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine has a molecular weight of 204.28 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-pyrazolo[1,5-a]pyrimidin-2-ylbutan-1-amine is sourced from PubChem (CID 83882052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).