N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine

C11H14N4O — CID 115372562

IUPACN-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESc1cc2nc(NC3CCCOC3)ccn2n1
InChIInChI=1S/C11H14N4O/c1-2-9(8-16-7-1)13-10-4-6-15-11(14-10)3-5-12-15/h3-6,9H,1-2,7-8H2,(H,13,14)
InChIKeyKHTJVQSCWUFPGB-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.32
Rot. Bonds2

About N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine

N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 115372562) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID115372562
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESc1cc2nc(NC3CCCOC3)ccn2n1
InChIInChI=1S/C11H14N4O/c1-2-9(8-16-7-1)13-10-4-6-15-11(14-10)3-5-12-15/h3-6,9H,1-2,7-8H2,(H,13,14)
InChIKeyKHTJVQSCWUFPGB-UHFFFAOYSA-N
XLogP1.32
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropylpyrazolo[1,5-a]pyrimidin-5-amine
CID 115372297
N-(3-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372348
N-(2-chlorocyclohexyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115373212
N-(2-methylcyclopentyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372556
N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372708
6-(1-methylpiperidin-4-yl)-N-(oxan-3-yl)pyridin-2-amine
CID 110271457
2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)cyclopentane-1-carboxylic acid
CID 113296576
2-N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]-4-N-[(3S)-oxan-3-yl]pyrimidine-2,4-diamine
CID 129343882
N-[(3S)-oxan-3-yl]pyrazin-2-amine
CID 130628778
4-bromo-N-(oxan-3-yl)pyridin-2-amine
CID 130608088
N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 91653166
2-N-methyl-4-N-(oxan-3-yl)-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 129001291

Frequently Asked Questions

What is the IUPAC name of N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine (CID 115372562) is N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine is c1cc2nc(NC3CCCOC3)ccn2n1.
What is the InChIKey of N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is KHTJVQSCWUFPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-2-9(8-16-7-1)13-10-4-6-15-11(14-10)3-5-12-15/h3-6,9H,1-2,7-8H2,(H,13,14).
What are the key properties of N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 218.26 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 115372562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).