7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

C13H8FN5 — CID 70686472

IUPAC7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnn2c(N)cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C13H8FN5/c14-10-3-1-8(2-4-10)11-5-12(16)19-13(18-11)9(6-15)7-17-19/h1-5,7H,16H2
InChIKeyMSGQJJJSDMXGKE-UHFFFAOYSA-N
MW253.24 g/mol
LogP1.99
Rot. Bonds1

About 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile (PubChem CID 70686472) has the molecular formula C13H8FN5 and a molecular weight of 253.24 g/mol. Its IUPAC name is 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile.

Molecular Properties

Compound Name7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
PubChem CID70686472
Molecular FormulaC13H8FN5
Molecular Weight253.24 g/mol
Exact Mass253.08
IUPAC Name7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnn2c(N)cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C13H8FN5/c14-10-3-1-8(2-4-10)11-5-12(16)19-13(18-11)9(6-15)7-17-19/h1-5,7H,16H2
InChIKeyMSGQJJJSDMXGKE-UHFFFAOYSA-N
XLogP1.99
TPSA80.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.24
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

7-(trifluoromethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 11405592
5-(1,3-benzodioxol-5-yl)-7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 4767360
2,6-bis(4-fluorophenyl)pyridine-4-carbonitrile
CID 46313546
5-(4-imidazol-1-ylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 4773526
2-(dimethylamino)-6-(4-fluorophenyl)pyrimidine-4-carbonitrile
CID 39346399
7-(1-adamantylamino)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 59053420
2-amino-4-chloropyrazolo[1,5-a][1,3,5]triazine-8-carbonitrile
CID 53487763
5-(4-fluorophenyl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 131986798
7-amino-5-phenylpyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile
CID 14950768
2-amino-4-(4-fluorophenyl)benzonitrile;ethane
CID 143899726
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-(difluoromethyl)-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19459871
6-(4-fluorophenyl)-2-methylsulfanylpyridine-3-carbonitrile
CID 2765290

Frequently Asked Questions

What is the IUPAC name of 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The IUPAC name of 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile (CID 70686472) is 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile.
What is the SMILES notation for 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The canonical SMILES for 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile is N#Cc1cnn2c(N)cc(-c3ccc(F)cc3)nc12.
What is the InChIKey of 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The InChIKey is MSGQJJJSDMXGKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FN5/c14-10-3-1-8(2-4-10)11-5-12(16)19-13(18-11)9(6-15)7-17-19/h1-5,7H,16H2.
What are the key properties of 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile has a molecular weight of 253.24 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-5-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile is sourced from PubChem (CID 70686472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).