2-propylpyrazolo[1,5-a]pyrimidin-3-amine

C9H12N4 — CID 115014726

IUPAC2-propylpyrazolo[1,5-a]pyrimidin-3-amine
SMILESCCCc1nn2cccnc2c1N
InChIInChI=1S/C9H12N4/c1-2-4-7-8(10)9-11-5-3-6-13(9)12-7/h3,5-6H,2,4,10H2,1H3
InChIKeyHOMDSXNUZWGBMS-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.26
Rot. Bonds2

About 2-propylpyrazolo[1,5-a]pyrimidin-3-amine

2-propylpyrazolo[1,5-a]pyrimidin-3-amine (PubChem CID 115014726) has the molecular formula C9H12N4 and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-propylpyrazolo[1,5-a]pyrimidin-3-amine.

Molecular Properties

Compound Name2-propylpyrazolo[1,5-a]pyrimidin-3-amine
PubChem CID115014726
Molecular FormulaC9H12N4
Molecular Weight176.22 g/mol
Exact Mass176.11
IUPAC Name2-propylpyrazolo[1,5-a]pyrimidin-3-amine
SMILESCCCc1nn2cccnc2c1N
InChIInChI=1S/C9H12N4/c1-2-4-7-8(10)9-11-5-3-6-13(9)12-7/h3,5-6H,2,4,10H2,1H3
InChIKeyHOMDSXNUZWGBMS-UHFFFAOYSA-N
XLogP1.26
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-aminopyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 66850701
3-octylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 175893742
3-(3-methyl-1-propylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
CID 134594362
1-methyl-3-propyl-5-(2-propylimidazol-1-yl)pyrazol-4-amine
CID 66017554
(2-tert-butylpyrazolo[1,5-a]pyrimidin-3-yl)methanamine
CID 82271992
2,3-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
CID 18504777
1-methyl-3-propyl-5-N-(pyridin-2-ylmethyl)pyrazole-4,5-diamine
CID 66019219
ethyl 2-bromopyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 71742950
5-ethoxy-1-methyl-3-propylpyrazol-4-amine
CID 66019111
2,3-ditert-butylpyrazolo[1,5-a]pyrimidine
CID 71288912
(2-cyclobutylpyrazolo[1,5-a]pyrimidin-3-yl)methanethiol
CID 82272076
3-(6-methylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
CID 58268969

Frequently Asked Questions

What is the IUPAC name of 2-propylpyrazolo[1,5-a]pyrimidin-3-amine?
The IUPAC name of 2-propylpyrazolo[1,5-a]pyrimidin-3-amine (CID 115014726) is 2-propylpyrazolo[1,5-a]pyrimidin-3-amine.
What is the SMILES notation for 2-propylpyrazolo[1,5-a]pyrimidin-3-amine?
The canonical SMILES for 2-propylpyrazolo[1,5-a]pyrimidin-3-amine is CCCc1nn2cccnc2c1N.
What is the InChIKey of 2-propylpyrazolo[1,5-a]pyrimidin-3-amine?
The InChIKey is HOMDSXNUZWGBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4/c1-2-4-7-8(10)9-11-5-3-6-13(9)12-7/h3,5-6H,2,4,10H2,1H3.
What are the key properties of 2-propylpyrazolo[1,5-a]pyrimidin-3-amine?
2-propylpyrazolo[1,5-a]pyrimidin-3-amine has a molecular weight of 176.22 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylpyrazolo[1,5-a]pyrimidin-3-amine is sourced from PubChem (CID 115014726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).