N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine

C11H19N3O — CID 115908239

IUPACN-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine
SMILESCC1CC(Nc2ccnn2C)CC(C)O1
InChIInChI=1S/C11H19N3O/c1-8-6-10(7-9(2)15-8)13-11-4-5-12-14(11)3/h4-5,8-10,13H,6-7H2,1-3H3
InChIKeyVMUNNHYXPYLKLQ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.79
Rot. Bonds2

About N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine

N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine (PubChem CID 115908239) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine
PubChem CID115908239
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine
SMILESCC1CC(Nc2ccnn2C)CC(C)O1
InChIInChI=1S/C11H19N3O/c1-8-6-10(7-9(2)15-8)13-11-4-5-12-14(11)3/h4-5,8-10,13H,6-7H2,1-3H3
InChIKeyVMUNNHYXPYLKLQ-UHFFFAOYSA-N
XLogP1.79
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine 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 N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine?
The IUPAC name of N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine (CID 115908239) is N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine.
What is the SMILES notation for N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine?
The canonical SMILES for N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine is CC1CC(Nc2ccnn2C)CC(C)O1.
What is the InChIKey of N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine?
The InChIKey is VMUNNHYXPYLKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8-6-10(7-9(2)15-8)13-11-4-5-12-14(11)3/h4-5,8-10,13H,6-7H2,1-3H3.
What are the key properties of N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine?
N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine has a molecular weight of 209.29 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethyloxan-4-yl)-2-methylpyrazol-3-amine is sourced from PubChem (CID 115908239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).