5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

C13H18N4 — CID 170418796

IUPAC5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(c1cc(N)n2nccc2n1)C1CCC1
InChIInChI=1S/C13H18N4/c1-2-10(9-4-3-5-9)11-8-12(14)17-13(16-11)6-7-15-17/h6-10H,2-5,14H2,1H3
InChIKeyXOMSHBOXHBHUGF-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.61
Rot. Bonds3

About 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 170418796) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID170418796
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(c1cc(N)n2nccc2n1)C1CCC1
InChIInChI=1S/C13H18N4/c1-2-10(9-4-3-5-9)11-8-12(14)17-13(16-11)6-7-15-17/h6-10H,2-5,14H2,1H3
InChIKeyXOMSHBOXHBHUGF-UHFFFAOYSA-N
XLogP2.61
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,3S)-3-N-[5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-yl]cyclopentane-1,3-diamine
CID 171409638
5-[(1R)-1-cyclopropylpropyl]-3-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 170416907
5-(cyclopropylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 90754073
5-(2-methylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 83697760
trans-(1S,3S)-3-N-(5-pentan-3-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclopentane-1,3-diamine;hydrochloride
CID 162370702
5-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 83705758
N-cyclohexyl-5-(1-cyclopropylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 170418529
1-(5-pentan-3-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclopentane-1,3-diamine
CID 175907250
5-(thian-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 66584856
4-(7-aminopyrazolo[1,5-a]pyrimidin-5-yl)cyclohexan-1-one
CID 66733850
ethyl 4-[(7-aminopyrazolo[1,5-a]pyrimidin-5-yl)methyl]cyclohexane-1-carboxylate
CID 66896915
trans-(1S,3S)-1-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]-3-N-(5-pentan-3-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclopentane-1,3-diamine;hydrochloride
CID 172840602

Frequently Asked Questions

What is the IUPAC name of 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 170418796) is 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCC(c1cc(N)n2nccc2n1)C1CCC1.
What is the InChIKey of 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is XOMSHBOXHBHUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-2-10(9-4-3-5-9)11-8-12(14)17-13(16-11)6-7-15-17/h6-10H,2-5,14H2,1H3.
What are the key properties of 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 230.31 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-cyclobutylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 170418796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).