7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine

C18H27N5O — CID 56888017

IUPAC7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
SMILESCOCc1cc(N2CCN(C3CCCCC3)CC2)n2nccc2n1
InChIInChI=1S/C18H27N5O/c1-24-14-15-13-18(23-17(20-15)7-8-19-23)22-11-9-21(10-12-22)16-5-3-2-4-6-16/h7-8,13,16H,2-6,9-12,14H2,1H3
InChIKeyYXLKTQKKKAJNAD-UHFFFAOYSA-N
MW329.45 g/mol
LogP2.33
Rot. Bonds4

About 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine

7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 56888017) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID56888017
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC Name7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
SMILESCOCc1cc(N2CCN(C3CCCCC3)CC2)n2nccc2n1
InChIInChI=1S/C18H27N5O/c1-24-14-15-13-18(23-17(20-15)7-8-19-23)22-11-9-21(10-12-22)16-5-3-2-4-6-16/h7-8,13,16H,2-6,9-12,14H2,1H3
InChIKeyYXLKTQKKKAJNAD-UHFFFAOYSA-N
XLogP2.33
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[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-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine (CID 56888017) is 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine is COCc1cc(N2CCN(C3CCCCC3)CC2)n2nccc2n1.
What is the InChIKey of 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is YXLKTQKKKAJNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-24-14-15-13-18(23-17(20-15)7-8-19-23)22-11-9-21(10-12-22)16-5-3-2-4-6-16/h7-8,13,16H,2-6,9-12,14H2,1H3.
What are the key properties of 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 329.45 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-cyclohexylpiperazin-1-yl)-5-(methoxymethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 56888017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).