4-methoxy-N-methylcyclohexan-1-amine

C8H17NO — CID 22224980

IUPAC4-methoxy-N-methylcyclohexan-1-amine
SMILESCNC1CCC(OC)CC1
InChIInChI=1S/C8H17NO/c1-9-7-3-5-8(10-2)6-4-7/h7-9H,3-6H2,1-2H3
InChIKeyZBUSNXOOCDOHST-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.16
Rot. Bonds2

About 4-methoxy-N-methylcyclohexan-1-amine

4-methoxy-N-methylcyclohexan-1-amine (PubChem CID 22224980) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-methoxy-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name4-methoxy-N-methylcyclohexan-1-amine
PubChem CID22224980
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-methoxy-N-methylcyclohexan-1-amine
SMILESCNC1CCC(OC)CC1
InChIInChI=1S/C8H17NO/c1-9-7-3-5-8(10-2)6-4-7/h7-9H,3-6H2,1-2H3
InChIKeyZBUSNXOOCDOHST-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methylcyclohexan-1-amine?
The IUPAC name of 4-methoxy-N-methylcyclohexan-1-amine (CID 22224980) is 4-methoxy-N-methylcyclohexan-1-amine.
What is the SMILES notation for 4-methoxy-N-methylcyclohexan-1-amine?
The canonical SMILES for 4-methoxy-N-methylcyclohexan-1-amine is CNC1CCC(OC)CC1.
What is the InChIKey of 4-methoxy-N-methylcyclohexan-1-amine?
The InChIKey is ZBUSNXOOCDOHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-9-7-3-5-8(10-2)6-4-7/h7-9H,3-6H2,1-2H3.
What are the key properties of 4-methoxy-N-methylcyclohexan-1-amine?
4-methoxy-N-methylcyclohexan-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methylcyclohexan-1-amine is sourced from PubChem (CID 22224980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).