4-methoxy-2-methylcyclohexan-1-amine

C8H17NO — CID 147825198

IUPAC4-methoxy-2-methylcyclohexan-1-amine
SMILESCOC1CCC(N)C(C)C1
InChIInChI=1S/C8H17NO/c1-6-5-7(10-2)3-4-8(6)9/h6-8H,3-5,9H2,1-2H3
InChIKeyJEALFIKHTDXSFG-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds1

About 4-methoxy-2-methylcyclohexan-1-amine

4-methoxy-2-methylcyclohexan-1-amine (PubChem CID 147825198) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-methoxy-2-methylcyclohexan-1-amine.

Molecular Properties

Compound Name4-methoxy-2-methylcyclohexan-1-amine
PubChem CID147825198
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-methoxy-2-methylcyclohexan-1-amine
SMILESCOC1CCC(N)C(C)C1
InChIInChI=1S/C8H17NO/c1-6-5-7(10-2)3-4-8(6)9/h6-8H,3-5,9H2,1-2H3
InChIKeyJEALFIKHTDXSFG-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,3R)-1,3-dimethoxycyclopentane
CID 22214084
trans-(1R,3R)-3-methoxycyclopentan-1-amine;hydrochloride
CID 118523425
trans-(1R,2R)-2-methylcyclopropan-1-amine
CID 12953691
2,4-dimethylcyclohexan-1-amine
CID 14675373
cis-(1S,2R)-2-methylcyclopropan-1-amine;hydrochloride
CID 146012745
4-methoxy-N,2-dimethylcyclohexan-1-amine
CID 146284377
(1R,2R,4S)-4-methoxy-2-methylcyclohexane-1-carboxylic acid
CID 125470813
2,4-dimethylcyclohexan-1-amine;dodecane
CID 174680887
4-[[(3S)-4-amino-3-methylcyclohexyl]methyl]-2-methylcyclohexan-1-amine
CID 146360825
propane;trans-(1S,3S)-1-methoxy-3-methylcyclopentane
CID 144913031
cis-(1S,3R)-3-methoxycyclohexan-1-amine
CID 51381085
4-[amino-(4-amino-3-methylcyclohexyl)methyl]-2-methylcyclohexan-1-amine
CID 141480966

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methylcyclohexan-1-amine?
The IUPAC name of 4-methoxy-2-methylcyclohexan-1-amine (CID 147825198) is 4-methoxy-2-methylcyclohexan-1-amine.
What is the SMILES notation for 4-methoxy-2-methylcyclohexan-1-amine?
The canonical SMILES for 4-methoxy-2-methylcyclohexan-1-amine is COC1CCC(N)C(C)C1.
What is the InChIKey of 4-methoxy-2-methylcyclohexan-1-amine?
The InChIKey is JEALFIKHTDXSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-6-5-7(10-2)3-4-8(6)9/h6-8H,3-5,9H2,1-2H3.
What are the key properties of 4-methoxy-2-methylcyclohexan-1-amine?
4-methoxy-2-methylcyclohexan-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methylcyclohexan-1-amine is sourced from PubChem (CID 147825198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).