1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine

C18H29NO — CID 115533850

IUPAC1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
SMILESCCOc1ccccc1C(NC)C1CCCCC1CC
InChIInChI=1S/C18H29NO/c1-4-14-10-6-7-11-15(14)18(19-3)16-12-8-9-13-17(16)20-5-2/h8-9,12-15,18-19H,4-7,10-11H2,1-3H3
InChIKeyOSCVBJIEEIOBJX-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.56
Rot. Bonds6

About 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine

1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine (PubChem CID 115533850) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
PubChem CID115533850
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
SMILESCCOc1ccccc1C(NC)C1CCCCC1CC
InChIInChI=1S/C18H29NO/c1-4-14-10-6-7-11-15(14)18(19-3)16-12-8-9-13-17(16)20-5-2/h8-9,12-15,18-19H,4-7,10-11H2,1-3H3
InChIKeyOSCVBJIEEIOBJX-UHFFFAOYSA-N
XLogP4.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 62801897
1-(2-ethylcyclohexyl)-N-methyl-1-naphthalen-1-ylmethanamine
CID 63862559
1-(1,1-dioxothian-2-yl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 115853689
1-(3,5-dimethylcyclohexyl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 115533801
N-[cyclopentyl-(2-ethoxyphenyl)methyl]propan-1-amine
CID 62802061
2-cyclopropyl-1-(2-ethoxyphenyl)-N-methylpropan-1-amine
CID 115853704
1-(2,4-dimethylphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
CID 115862504
1-(2-bromo-4-methylphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
CID 115862601
[(2,3-dimethoxyphenyl)-(2-ethylcyclohexyl)methyl]hydrazine
CID 105309720
N-[cyclobutyl-(2-ethoxyphenyl)methyl]propan-1-amine
CID 64987111
N-[(2-chlorophenyl)-(2-ethylcyclohexyl)methyl]ethanamine
CID 63863652
N-[6-bicyclo[3.1.0]hexanyl-(2-ethoxyphenyl)methyl]ethanamine
CID 115853710

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine (CID 115533850) is 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine is CCOc1ccccc1C(NC)C1CCCCC1CC.
What is the InChIKey of 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine?
The InChIKey is OSCVBJIEEIOBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-4-14-10-6-7-11-15(14)18(19-3)16-12-8-9-13-17(16)20-5-2/h8-9,12-15,18-19H,4-7,10-11H2,1-3H3.
What are the key properties of 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine?
1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine has a molecular weight of 275.44 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-1-(2-ethylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 115533850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).