6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine

C14H20N2O — CID 174784237

IUPAC6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine
SMILESCC1(N)C=CC=CC1OC1C=CC=CC1(C)N
InChIInChI=1S/C14H20N2O/c1-13(15)9-5-3-7-11(13)17-12-8-4-6-10-14(12,2)16/h3-12H,15-16H2,1-2H3
InChIKeyATACXFIBZBOCTM-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.43
Rot. Bonds2

About 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine

6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine (PubChem CID 174784237) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine
PubChem CID174784237
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine
SMILESCC1(N)C=CC=CC1OC1C=CC=CC1(C)N
InChIInChI=1S/C14H20N2O/c1-13(15)9-5-3-7-11(13)17-12-8-4-6-10-14(12,2)16/h3-12H,15-16H2,1-2H3
InChIKeyATACXFIBZBOCTM-UHFFFAOYSA-N
XLogP1.43
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-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 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine?
The IUPAC name of 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine (CID 174784237) is 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine?
The canonical SMILES for 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine is CC1(N)C=CC=CC1OC1C=CC=CC1(C)N.
What is the InChIKey of 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine?
The InChIKey is ATACXFIBZBOCTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-13(15)9-5-3-7-11(13)17-12-8-4-6-10-14(12,2)16/h3-12H,15-16H2,1-2H3.
What are the key properties of 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine?
6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine has a molecular weight of 232.33 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-amino-6-methylcyclohexa-2,4-dien-1-yl)oxy-1-methylcyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 174784237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).