[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol

C14H24N4O — CID 86804870

IUPAC[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
SMILESCCc1nnc(NC2CCCCC2CO)nc1CC
InChIInChI=1S/C14H24N4O/c1-3-11-12(4-2)17-18-14(15-11)16-13-8-6-5-7-10(13)9-19/h10,13,19H,3-9H2,1-2H3,(H,15,16,18)
InChIKeyGEPHPYXDUDMRTB-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.96
Rot. Bonds5

About [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol

[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol (PubChem CID 86804870) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
PubChem CID86804870
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol
SMILESCCc1nnc(NC2CCCCC2CO)nc1CC
InChIInChI=1S/C14H24N4O/c1-3-11-12(4-2)17-18-14(15-11)16-13-8-6-5-7-10(13)9-19/h10,13,19H,3-9H2,1-2H3,(H,15,16,18)
InChIKeyGEPHPYXDUDMRTB-UHFFFAOYSA-N
XLogP1.96
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol (CID 86804870) is [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol is CCc1nnc(NC2CCCCC2CO)nc1CC.
What is the InChIKey of [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
The InChIKey is GEPHPYXDUDMRTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-11-12(4-2)17-18-14(15-11)16-13-8-6-5-7-10(13)9-19/h10,13,19H,3-9H2,1-2H3,(H,15,16,18).
What are the key properties of [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol?
[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol has a molecular weight of 264.37 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 86804870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).