6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine

C14H17N7 — CID 118456706

IUPAC6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
SMILESc1nc2c(Nc3cn[nH]c3)nc(C3CCCCC3)cn2n1
InChIInChI=1S/C14H17N7/c1-2-4-10(5-3-1)12-8-21-14(15-9-18-21)13(20-12)19-11-6-16-17-7-11/h6-10H,1-5H2,(H,16,17)(H,19,20)
InChIKeyJNRVVKVGDDBQMJ-UHFFFAOYSA-N
MW283.34 g/mol
LogP2.64
Rot. Bonds3

About 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine

6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine (PubChem CID 118456706) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
PubChem CID118456706
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC Name6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
SMILESc1nc2c(Nc3cn[nH]c3)nc(C3CCCCC3)cn2n1
InChIInChI=1S/C14H17N7/c1-2-4-10(5-3-1)12-8-21-14(15-9-18-21)13(20-12)19-11-6-16-17-7-11/h6-10H,1-5H2,(H,16,17)(H,19,20)
InChIKeyJNRVVKVGDDBQMJ-UHFFFAOYSA-N
XLogP2.64
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The IUPAC name of 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine (CID 118456706) is 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine is c1nc2c(Nc3cn[nH]c3)nc(C3CCCCC3)cn2n1.
What is the InChIKey of 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The InChIKey is JNRVVKVGDDBQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-2-4-10(5-3-1)12-8-21-14(15-9-18-21)13(20-12)19-11-6-16-17-7-11/h6-10H,1-5H2,(H,16,17)(H,19,20).
What are the key properties of 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine has a molecular weight of 283.34 g/mol, XLogP of 2.64, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-N-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 118456706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).