4-methoxy-N,2-dimethylcyclohexan-1-amine

C9H19NO — CID 146284377

IUPAC4-methoxy-N,2-dimethylcyclohexan-1-amine
SMILESCNC1CCC(OC)CC1C
InChIInChI=1S/C9H19NO/c1-7-6-8(11-3)4-5-9(7)10-2/h7-10H,4-6H2,1-3H3
InChIKeyDEVYQZYUCFLTJJ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds2

About 4-methoxy-N,2-dimethylcyclohexan-1-amine

4-methoxy-N,2-dimethylcyclohexan-1-amine (PubChem CID 146284377) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-methoxy-N,2-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name4-methoxy-N,2-dimethylcyclohexan-1-amine
PubChem CID146284377
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-methoxy-N,2-dimethylcyclohexan-1-amine
SMILESCNC1CCC(OC)CC1C
InChIInChI=1S/C9H19NO/c1-7-6-8(11-3)4-5-9(7)10-2/h7-10H,4-6H2,1-3H3
InChIKeyDEVYQZYUCFLTJJ-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,2-dimethylcyclohexan-1-amine?
The IUPAC name of 4-methoxy-N,2-dimethylcyclohexan-1-amine (CID 146284377) is 4-methoxy-N,2-dimethylcyclohexan-1-amine.
What is the SMILES notation for 4-methoxy-N,2-dimethylcyclohexan-1-amine?
The canonical SMILES for 4-methoxy-N,2-dimethylcyclohexan-1-amine is CNC1CCC(OC)CC1C.
What is the InChIKey of 4-methoxy-N,2-dimethylcyclohexan-1-amine?
The InChIKey is DEVYQZYUCFLTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-7-6-8(11-3)4-5-9(7)10-2/h7-10H,4-6H2,1-3H3.
What are the key properties of 4-methoxy-N,2-dimethylcyclohexan-1-amine?
4-methoxy-N,2-dimethylcyclohexan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,2-dimethylcyclohexan-1-amine is sourced from PubChem (CID 146284377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).