N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine

C11H16N4O — CID 115372504

IUPACN-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOCC(C)CNc1ccn2nccc2n1
InChIInChI=1S/C11H16N4O/c1-9(8-16-2)7-12-10-4-6-15-11(14-10)3-5-13-15/h3-6,9H,7-8H2,1-2H3,(H,12,14)
InChIKeyIMXFOACMASDSSM-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.42
Rot. Bonds5

About N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine

N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 115372504) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID115372504
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOCC(C)CNc1ccn2nccc2n1
InChIInChI=1S/C11H16N4O/c1-9(8-16-2)7-12-10-4-6-15-11(14-10)3-5-13-15/h3-6,9H,7-8H2,1-2H3,(H,12,14)
InChIKeyIMXFOACMASDSSM-UHFFFAOYSA-N
XLogP1.42
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine (CID 115372504) is N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine is COCC(C)CNc1ccn2nccc2n1.
What is the InChIKey of N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is IMXFOACMASDSSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-9(8-16-2)7-12-10-4-6-15-11(14-10)3-5-13-15/h3-6,9H,7-8H2,1-2H3,(H,12,14).
What are the key properties of N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine?
N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 220.28 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 115372504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).