(4-methoxy-1-methylcyclohexyl)azanium

C8H18NO+ — CID 143542596

IUPAC(4-methoxy-1-methylcyclohexyl)azanium
SMILESCOC1CCC(C)([NH3+])CC1
InChIInChI=1S/C8H17NO/c1-8(9)5-3-7(10-2)4-6-8/h7H,3-6,9H2,1-2H3/p+1
InChIKeyXJUADFOJRYMBJV-UHFFFAOYSA-O
MW144.24 g/mol
LogP0.58
Rot. Bonds1

About (4-methoxy-1-methylcyclohexyl)azanium

(4-methoxy-1-methylcyclohexyl)azanium (PubChem CID 143542596) has the molecular formula C8H18NO+ and a molecular weight of 144.24 g/mol. Its IUPAC name is (4-methoxy-1-methylcyclohexyl)azanium.

Molecular Properties

Compound Name(4-methoxy-1-methylcyclohexyl)azanium
PubChem CID143542596
Molecular FormulaC8H18NO+
Molecular Weight144.24 g/mol
Exact Mass144.14
IUPAC Name(4-methoxy-1-methylcyclohexyl)azanium
SMILESCOC1CCC(C)([NH3+])CC1
InChIInChI=1S/C8H17NO/c1-8(9)5-3-7(10-2)4-6-8/h7H,3-6,9H2,1-2H3/p+1
InChIKeyXJUADFOJRYMBJV-UHFFFAOYSA-O
XLogP0.58
TPSA36.87 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methoxy-1-methylcyclohexan-1-amine
CID 59419772
1,1-dichloro-4-methoxycyclohexane
CID 123609119
1-amino-4-methoxycyclohexan-1-ol
CID 170572997
4-methoxycyclohexane-1,1-dicarboxylate
CID 140732737
1-ethenyl-4-methoxycyclohexan-1-ol
CID 12643103
1,1-difluoro-4-methoxycyclooctane
CID 129088845
methoxycyclooctane
CID 551195
methoxycyclopentane;dihydrate
CID 159895201
azane;methoxycyclopentane
CID 70270429
3-methoxyspiro[4.4]nonane
CID 129102731
1-(4-methoxy-1-methylcyclohexyl)piperidin-4-one
CID 59419757
3-[(4-methoxy-1-methylcyclohexyl)methoxy]propan-1-amine
CID 121378923

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-methylcyclohexyl)azanium?
The IUPAC name of (4-methoxy-1-methylcyclohexyl)azanium (CID 143542596) is (4-methoxy-1-methylcyclohexyl)azanium.
What is the SMILES notation for (4-methoxy-1-methylcyclohexyl)azanium?
The canonical SMILES for (4-methoxy-1-methylcyclohexyl)azanium is COC1CCC(C)([NH3+])CC1.
What is the InChIKey of (4-methoxy-1-methylcyclohexyl)azanium?
The InChIKey is XJUADFOJRYMBJV-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H17NO/c1-8(9)5-3-7(10-2)4-6-8/h7H,3-6,9H2,1-2H3/p+1.
What are the key properties of (4-methoxy-1-methylcyclohexyl)azanium?
(4-methoxy-1-methylcyclohexyl)azanium has a molecular weight of 144.24 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-methylcyclohexyl)azanium is sourced from PubChem (CID 143542596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).