7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine

C14H18ClN3 — CID 89351662

IUPAC7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine
SMILESCc1cnn2c(Cl)cc(CC3CCCCC3)nc12
InChIInChI=1S/C14H18ClN3/c1-10-9-16-18-13(15)8-12(17-14(10)18)7-11-5-3-2-4-6-11/h8-9,11H,2-7H2,1H3
InChIKeyUEIUFWLNGJUQGW-UHFFFAOYSA-N
MW263.77 g/mol
LogP3.81
Rot. Bonds2

About 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine

7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine (PubChem CID 89351662) has the molecular formula C14H18ClN3 and a molecular weight of 263.77 g/mol. Its IUPAC name is 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine
PubChem CID89351662
Molecular FormulaC14H18ClN3
Molecular Weight263.77 g/mol
Exact Mass263.12
IUPAC Name7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine
SMILESCc1cnn2c(Cl)cc(CC3CCCCC3)nc12
InChIInChI=1S/C14H18ClN3/c1-10-9-16-18-13(15)8-12(17-14(10)18)7-11-5-3-2-4-6-11/h8-9,11H,2-7H2,1H3
InChIKeyUEIUFWLNGJUQGW-UHFFFAOYSA-N
XLogP3.81
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine 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 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine (CID 89351662) is 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine is Cc1cnn2c(Cl)cc(CC3CCCCC3)nc12.
What is the InChIKey of 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine?
The InChIKey is UEIUFWLNGJUQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3/c1-10-9-16-18-13(15)8-12(17-14(10)18)7-11-5-3-2-4-6-11/h8-9,11H,2-7H2,1H3.
What are the key properties of 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine?
7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine has a molecular weight of 263.77 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 89351662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).