5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine

C15H22N4O — CID 70782443

IUPAC5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCCCC2CCOC2)n2nccc2n1
InChIInChI=1S/C15H22N4O/c1-2-13-10-15(19-14(18-13)5-8-17-19)16-7-3-4-12-6-9-20-11-12/h5,8,10,12,16H,2-4,6-7,9,11H2,1H3
InChIKeyWUWLWLGAPLYNFQ-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.52
Rot. Bonds6

About 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70782443) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70782443
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCCCC2CCOC2)n2nccc2n1
InChIInChI=1S/C15H22N4O/c1-2-13-10-15(19-14(18-13)5-8-17-19)16-7-3-4-12-6-9-20-11-12/h5,8,10,12,16H,2-4,6-7,9,11H2,1H3
InChIKeyWUWLWLGAPLYNFQ-UHFFFAOYSA-N
XLogP2.52
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Istisociclib
CID 146502834
8-Pyrrolidin-1-yl-2,6,7,12-tetrazatricyclo[7.5.0.03,7]tetradeca-1,3,5,8-tetraene
CID 53321947
3-Ethyl-5-(piperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 53318090
N-ethyl-N-methyl-2,6,7,12-tetrazatricyclo[7.5.0.03,7]tetradeca-1,3,5,8-tetraen-8-amine
CID 53320653
N-ethyl-2,6,7,12-tetrazatricyclo[7.5.0.03,7]tetradeca-1,3,5,8-tetraen-8-amine
CID 53324165
5-(Piperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 53318088
US9932325, Example 193
CID 132244742
2170137-61-6 (Free base)
CID 153488764
(1R*,3R*)-N-(5-propylpyrazolo[1,5-a]pyrimidin-7-yl)-1,3-cyclopentanediamine
CID 56915928
cis-(1S,3R)-3-N-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclopentane-1,3-diamine
CID 146502786
1-N-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclobutane-1,3-diamine
CID 146502810
trans-(1S,3S)-3-N-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)cyclopentane-1,3-diamine
CID 146502817

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 70782443) is 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(NCCCC2CCOC2)n2nccc2n1.
What is the InChIKey of 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is WUWLWLGAPLYNFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-2-13-10-15(19-14(18-13)5-8-17-19)16-7-3-4-12-6-9-20-11-12/h5,8,10,12,16H,2-4,6-7,9,11H2,1H3.
What are the key properties of 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 274.37 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[3-(oxolan-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70782443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).