6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C19H15ClFN5 — CID 164612232

IUPAC6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1nc2c(-c3ccc(F)cc3)cnn2c(NCc2ccccn2)c1Cl
InChIInChI=1S/C19H15ClFN5/c1-12-17(20)19(23-10-15-4-2-3-9-22-15)26-18(25-12)16(11-24-26)13-5-7-14(21)8-6-13/h2-9,11,23H,10H2,1H3
InChIKeyYDBXMXRMMLZUSL-UHFFFAOYSA-N
MW367.82 g/mol
LogP4.50
Rot. Bonds4

About 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 164612232) has the molecular formula C19H15ClFN5 and a molecular weight of 367.82 g/mol. Its IUPAC name is 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID164612232
Molecular FormulaC19H15ClFN5
Molecular Weight367.82 g/mol
Exact Mass367.10
IUPAC Name6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1nc2c(-c3ccc(F)cc3)cnn2c(NCc2ccccn2)c1Cl
InChIInChI=1S/C19H15ClFN5/c1-12-17(20)19(23-10-15-4-2-3-9-22-15)26-18(25-12)16(11-24-26)13-5-7-14(21)8-6-13/h2-9,11,23H,10H2,1H3
InChIKeyYDBXMXRMMLZUSL-UHFFFAOYSA-N
XLogP4.50
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.82
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-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 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 164612232) is 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is Cc1nc2c(-c3ccc(F)cc3)cnn2c(NCc2ccccn2)c1Cl.
What is the InChIKey of 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is YDBXMXRMMLZUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN5/c1-12-17(20)19(23-10-15-4-2-3-9-22-15)26-18(25-12)16(11-24-26)13-5-7-14(21)8-6-13/h2-9,11,23H,10H2,1H3.
What are the key properties of 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 367.82 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(4-fluorophenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 164612232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).