1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine

C11H23NO — CID 62108178

IUPAC1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(CNC)(OC)CC1
InChIInChI=1S/C11H23NO/c1-4-10-5-7-11(13-3,8-6-10)9-12-2/h10,12H,4-9H2,1-3H3
InChIKeyVZAWCKNJHULOFS-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds4

About 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine

1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine (PubChem CID 62108178) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine
PubChem CID62108178
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(CNC)(OC)CC1
InChIInChI=1S/C11H23NO/c1-4-10-5-7-11(13-3,8-6-10)9-12-2/h10,12H,4-9H2,1-3H3
InChIKeyVZAWCKNJHULOFS-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine (CID 62108178) is 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine is CCC1CCC(CNC)(OC)CC1.
What is the InChIKey of 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine?
The InChIKey is VZAWCKNJHULOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-10-5-7-11(13-3,8-6-10)9-12-2/h10,12H,4-9H2,1-3H3.
What are the key properties of 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine?
1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 62108178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).