6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine

C10H17NO — CID 22065600

IUPAC6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine
SMILESCOC1(C)C(C)=C(C)C=CC1N
InChIInChI=1S/C10H17NO/c1-7-5-6-9(11)10(3,12-4)8(7)2/h5-6,9H,11H2,1-4H3
InChIKeyOZKGYEKGUBLEMV-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.62
Rot. Bonds1

About 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine

6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine (PubChem CID 22065600) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine
PubChem CID22065600
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine
SMILESCOC1(C)C(C)=C(C)C=CC1N
InChIInChI=1S/C10H17NO/c1-7-5-6-9(11)10(3,12-4)8(7)2/h5-6,9H,11H2,1-4H3
InChIKeyOZKGYEKGUBLEMV-UHFFFAOYSA-N
XLogP1.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine with MolForge

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Related Compounds

6-Methoxy-6-(trifluoromethyl)cyclohexa-2,4-dien-1-amine
CID 69301389
6-Fluoro-6-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-amine
CID 117926838
(Z,4E)-4-ethylidene-1-fluoro-3-methoxynon-5-en-2-amine
CID 129313612
1-(4,4-Dimethylcyclohexa-1,5-dien-1-yl)-3-fluoro-1-methoxypropan-2-amine
CID 145467293
1-(1,6-Dimethylphenoxy)-2-aminopropane
CID 129724544
(Z,4E)-1-fluoro-3-methoxy-7-methyl-4-prop-2-enylidenenon-5-en-2-amine
CID 143418433
1-(1-Methoxycyclohexa-2,4-dien-1-yl)ethanamine
CID 22011035
6-Methoxy-6-methylcyclohexa-2,4-dien-1-amine
CID 67028805
6-Ethoxy-6-methyl-3-propan-2-ylcyclohexa-2,4-dien-1-amine;hydrochloride
CID 67053082
6-Tert-butyl-6-methoxycyclohexa-2,4-dien-1-amine
CID 67060123
(1-Methoxycyclohexa-2,4-dien-1-yl)methanamine
CID 67613783
6-Ethoxy-6-ethylcyclohexa-2,4-dien-1-amine
CID 67857196

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine?
The IUPAC name of 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine (CID 22065600) is 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine?
The canonical SMILES for 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine is COC1(C)C(C)=C(C)C=CC1N.
What is the InChIKey of 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine?
The InChIKey is OZKGYEKGUBLEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-7-5-6-9(11)10(3,12-4)8(7)2/h5-6,9H,11H2,1-4H3.
What are the key properties of 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine?
6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine has a molecular weight of 167.25 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 22065600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).