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

C16H16FN5 — CID 140870054

IUPAC5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
SMILESNc1cnn2ccc(N3CCC[C@@H]3c3ccccc3F)nc12
InChIInChI=1S/C16H16FN5/c17-12-5-2-1-4-11(12)14-6-3-8-21(14)15-7-9-22-16(20-15)13(18)10-19-22/h1-2,4-5,7,9-10,14H,3,6,8,18H2/t14-/m1/s1
InChIKeyOXEWLZCSLNJHMR-CQSZACIVSA-N
MW297.34 g/mol
LogP2.79
Rot. Bonds2

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

5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine (PubChem CID 140870054) has the molecular formula C16H16FN5 and a molecular weight of 297.34 g/mol. Its IUPAC name is 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine.

Molecular Properties

Compound Name5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
PubChem CID140870054
Molecular FormulaC16H16FN5
Molecular Weight297.34 g/mol
Exact Mass297.14
IUPAC Name5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
SMILESNc1cnn2ccc(N3CCC[C@@H]3c3ccccc3F)nc12
InChIInChI=1S/C16H16FN5/c17-12-5-2-1-4-11(12)14-6-3-8-21(14)15-7-9-22-16(20-15)13(18)10-19-22/h1-2,4-5,7,9-10,14H,3,6,8,18H2/t14-/m1/s1
InChIKeyOXEWLZCSLNJHMR-CQSZACIVSA-N
XLogP2.79
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
CID 67329531
5-[(2R)-2-[5-fluoro-2-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
CID 67332033
5-[4,4-dideuterio-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
CID 156673856
5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-3-ethynylpyrazolo[1,5-a]pyrimidine
CID 121395277
5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbaldehyde
CID 121395110
5-(2-but-1-en-2-ylpyrrolidin-1-yl)pyrazolo[1,5-a]pyrimidin-3-amine
CID 146209357
N-[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]pyridine-2-carboxamide
CID 45273880
(3S)-1-[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]pyrrolidin-3-ol
CID 121333491
N-[5-[2-(2,3-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-methylpyridine-2-carboxamide
CID 174226829
2-[[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]amino]-2-oxoacetic acid
CID 58386308
5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]-3-(4-iodopyrazol-1-yl)pyrazolo[1,5-a]pyrimidine
CID 138690076
5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-N-(2-fluoro-2-methylpropyl)pyrazolo[1,5-a]pyrimidin-3-amine
CID 90788377

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The IUPAC name of 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine (CID 140870054) is 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine.
What is the SMILES notation for 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The canonical SMILES for 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine is Nc1cnn2ccc(N3CCC[C@@H]3c3ccccc3F)nc12.
What is the InChIKey of 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
The InChIKey is OXEWLZCSLNJHMR-CQSZACIVSA-N. The full InChI is InChI=1S/C16H16FN5/c17-12-5-2-1-4-11(12)14-6-3-8-21(14)15-7-9-22-16(20-15)13(18)10-19-22/h1-2,4-5,7,9-10,14H,3,6,8,18H2/t14-/m1/s1.
What are the key properties of 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine?
5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine has a molecular weight of 297.34 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-(2-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine is sourced from PubChem (CID 140870054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).