5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine

C17H18FN5 — CID 67329558

IUPAC5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
SMILESCC1(c2cccc(F)c2)CCCN1c1ccn2ncc(N)c2n1
InChIInChI=1S/C17H18FN5/c1-17(12-4-2-5-13(18)10-12)7-3-8-22(17)15-6-9-23-16(21-15)14(19)11-20-23/h2,4-6,9-11H,3,7-8,19H2,1H3
InChIKeyWRLDGWUCMXDRJT-UHFFFAOYSA-N
MW311.36 g/mol
LogP2.97
Rot. Bonds2

About 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine

5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine (PubChem CID 67329558) has the molecular formula C17H18FN5 and a molecular weight of 311.36 g/mol. Its IUPAC name is 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine.

Molecular Properties

Compound Name5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
PubChem CID67329558
Molecular FormulaC17H18FN5
Molecular Weight311.36 g/mol
Exact Mass311.15
IUPAC Name5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
SMILESCC1(c2cccc(F)c2)CCCN1c1ccn2ncc(N)c2n1
InChIInChI=1S/C17H18FN5/c1-17(12-4-2-5-13(18)10-12)7-3-8-22(17)15-6-9-23-16(21-15)14(19)11-20-23/h2,4-6,9-11H,3,7-8,19H2,1H3
InChIKeyWRLDGWUCMXDRJT-UHFFFAOYSA-N
XLogP2.97
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The IUPAC name of 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine (CID 67329558) is 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine.
What is the SMILES notation for 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The canonical SMILES for 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine is CC1(c2cccc(F)c2)CCCN1c1ccn2ncc(N)c2n1.
What is the InChIKey of 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The InChIKey is WRLDGWUCMXDRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN5/c1-17(12-4-2-5-13(18)10-12)7-3-8-22(17)15-6-9-23-16(21-15)14(19)11-20-23/h2,4-6,9-11H,3,7-8,19H2,1H3.
What are the key properties of 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine has a molecular weight of 311.36 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-fluorophenyl)-2-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine is sourced from PubChem (CID 67329558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).