7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine

C14H17N7 — CID 15958068

IUPAC7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cnc2c(-c3nn[nH]n3)cnn2c1C1CCCCC1
InChIInChI=1S/C14H17N7/c1-9-7-15-14-11(13-17-19-20-18-13)8-16-21(14)12(9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,17,18,19,20)
InChIKeyPBEUYRFFJZIZIM-UHFFFAOYSA-N
MW283.34 g/mol
LogP2.27
Rot. Bonds2

About 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine

7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine (PubChem CID 15958068) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine
PubChem CID15958068
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC Name7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cnc2c(-c3nn[nH]n3)cnn2c1C1CCCCC1
InChIInChI=1S/C14H17N7/c1-9-7-15-14-11(13-17-19-20-18-13)8-16-21(14)12(9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,17,18,19,20)
InChIKeyPBEUYRFFJZIZIM-UHFFFAOYSA-N
XLogP2.27
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine (CID 15958068) is 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine is Cc1cnc2c(-c3nn[nH]n3)cnn2c1C1CCCCC1.
What is the InChIKey of 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is PBEUYRFFJZIZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-9-7-15-14-11(13-17-19-20-18-13)8-16-21(14)12(9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,17,18,19,20).
What are the key properties of 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine?
7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 283.34 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-6-methyl-3-(2H-tetrazol-5-yl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 15958068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).