3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine

C11H15N5 — CID 117103388

IUPAC3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine
SMILESCN1CCC(c2cnn3cc(N)cnc23)C1
InChIInChI=1S/C11H15N5/c1-15-3-2-8(6-15)10-5-14-16-7-9(12)4-13-11(10)16/h4-5,7-8H,2-3,6,12H2,1H3
InChIKeyPLWHRVYJDSTJJB-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.73
Rot. Bonds1

About 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine

3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine (PubChem CID 117103388) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine.

Molecular Properties

Compound Name3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine
PubChem CID117103388
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine
SMILESCN1CCC(c2cnn3cc(N)cnc23)C1
InChIInChI=1S/C11H15N5/c1-15-3-2-8(6-15)10-5-14-16-7-9(12)4-13-11(10)16/h4-5,7-8H,2-3,6,12H2,1H3
InChIKeyPLWHRVYJDSTJJB-UHFFFAOYSA-N
XLogP0.73
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine?
The IUPAC name of 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine (CID 117103388) is 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine.
What is the SMILES notation for 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine?
The canonical SMILES for 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine is CN1CCC(c2cnn3cc(N)cnc23)C1.
What is the InChIKey of 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine?
The InChIKey is PLWHRVYJDSTJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-15-3-2-8(6-15)10-5-14-16-7-9(12)4-13-11(10)16/h4-5,7-8H,2-3,6,12H2,1H3.
What are the key properties of 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine?
3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine has a molecular weight of 217.28 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidin-6-amine is sourced from PubChem (CID 117103388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).