3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol

C10H16N4O — CID 128837067

IUPAC3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol
SMILESCc1nnc(NC2CC(C)(O)C2)nc1C
InChIInChI=1S/C10H16N4O/c1-6-7(2)13-14-9(11-6)12-8-4-10(3,15)5-8/h8,15H,4-5H2,1-3H3,(H,11,12,14)
InChIKeyONMOPXYULNNVMT-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.81
Rot. Bonds2

About 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol

3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol (PubChem CID 128837067) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol.

Molecular Properties

Compound Name3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol
PubChem CID128837067
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol
SMILESCc1nnc(NC2CC(C)(O)C2)nc1C
InChIInChI=1S/C10H16N4O/c1-6-7(2)13-14-9(11-6)12-8-4-10(3,15)5-8/h8,15H,4-5H2,1-3H3,(H,11,12,14)
InChIKeyONMOPXYULNNVMT-UHFFFAOYSA-N
XLogP0.81
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol?
The IUPAC name of 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol (CID 128837067) is 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol.
What is the SMILES notation for 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol?
The canonical SMILES for 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol is Cc1nnc(NC2CC(C)(O)C2)nc1C.
What is the InChIKey of 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol?
The InChIKey is ONMOPXYULNNVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-7(2)13-14-9(11-6)12-8-4-10(3,15)5-8/h8,15H,4-5H2,1-3H3,(H,11,12,14).
What are the key properties of 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol?
3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol has a molecular weight of 208.26 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-1-methylcyclobutan-1-ol is sourced from PubChem (CID 128837067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).