5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

C20H18FN5 — CID 56918481

IUPAC5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(Nc1cc(-c2ccc(F)cc2)nc2ccnn12)c1cccnc1
InChIInChI=1S/C20H18FN5/c1-2-17(15-4-3-10-22-13-15)24-20-12-18(14-5-7-16(21)8-6-14)25-19-9-11-23-26(19)20/h3-13,17,24H,2H2,1H3
InChIKeyDNNFQECYRPMCME-UHFFFAOYSA-N
MW347.40 g/mol
LogP4.49
Rot. Bonds5

About 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56918481) has the molecular formula C20H18FN5 and a molecular weight of 347.40 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56918481
Molecular FormulaC20H18FN5
Molecular Weight347.40 g/mol
Exact Mass347.15
IUPAC Name5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(Nc1cc(-c2ccc(F)cc2)nc2ccnn12)c1cccnc1
InChIInChI=1S/C20H18FN5/c1-2-17(15-4-3-10-22-13-15)24-20-12-18(14-5-7-16(21)8-6-14)25-19-9-11-23-26(19)20/h3-13,17,24H,2H2,1H3
InChIKeyDNNFQECYRPMCME-UHFFFAOYSA-N
XLogP4.49
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-fluorophenyl)-N-[(1S)-1-pyridin-3-ylpropyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95863142
5-(4-fluorophenyl)-N-[(1R)-1-pyridin-3-ylpropyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95863143
5-(4-fluorophenyl)-N-(1-imidazol-1-ylbutan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56897885
N-[(1R)-1-(2-ethyl-1,2,4-triazol-3-yl)propyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 95719174
5-(4-fluorophenyl)-N-[(1R)-1-(2-propyl-1,2,4-triazol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95896744
5-(4-fluorophenyl)-N-[(4-methyl-2-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56885537
5-phenyl-N-[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95712908
N-[2-(1H-imidazol-5-yl)ethyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56902858
5-methyl-N-[(2R)-1-pyridin-3-ylpropan-2-yl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95861751
N-[1-(1H-imidazol-2-yl)propyl]-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 129284743
7-methyl-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
CID 71200006
4-[(1S,2R)-1-hydroxy-2-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl]phenol
CID 70722404

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56918481) is 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCC(Nc1cc(-c2ccc(F)cc2)nc2ccnn12)c1cccnc1.
What is the InChIKey of 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is DNNFQECYRPMCME-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5/c1-2-17(15-4-3-10-22-13-15)24-20-12-18(14-5-7-16(21)8-6-14)25-19-9-11-23-26(19)20/h3-13,17,24H,2H2,1H3.
What are the key properties of 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 347.40 g/mol, XLogP of 4.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-(1-pyridin-3-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56918481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).