(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine

C17H27NO2 — CID 116763532

IUPAC(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCCOC1(C(N)c2cc(C)ccc2OC)CCCCC1
InChIInChI=1S/C17H27NO2/c1-4-20-17(10-6-5-7-11-17)16(18)14-12-13(2)8-9-15(14)19-3/h8-9,12,16H,4-7,10-11,18H2,1-3H3
InChIKeyUVZUVGURDZOUEX-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.74
Rot. Bonds5

About (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine

(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine (PubChem CID 116763532) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine.

Molecular Properties

Compound Name(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
PubChem CID116763532
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCCOC1(C(N)c2cc(C)ccc2OC)CCCCC1
InChIInChI=1S/C17H27NO2/c1-4-20-17(10-6-5-7-11-17)16(18)14-12-13(2)8-9-15(14)19-3/h8-9,12,16H,4-7,10-11,18H2,1-3H3
InChIKeyUVZUVGURDZOUEX-UHFFFAOYSA-N
XLogP3.74
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chloro-2-methoxyphenyl)-(1-ethoxycycloheptyl)methanamine
CID 116770642
(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753700
(1-ethoxycycloheptyl)-(2-fluoro-5-methylphenyl)methanamine
CID 116770564
(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine
CID 106826973
(1-ethoxycyclopentyl)-(4-methoxy-2,5-dimethylphenyl)methanamine
CID 116761694
(2,6-dimethoxyphenyl)-(1-ethoxycyclopentyl)methanamine
CID 116810819
(1-methoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753417
(2-methoxy-5-methylphenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79059206
(1-ethoxycyclopentyl)-(2-methoxy-3,4-dimethylphenyl)methanamine
CID 103433954
1-(1-ethoxycyclopentyl)-2-(2-methoxy-5-methylphenyl)-N-methylethanamine
CID 116762040
[(1-methoxycyclopentyl)-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105268692
(1-ethoxycyclohexyl)-(3-methoxyphenyl)methanamine
CID 116763600

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine?
The IUPAC name of (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine (CID 116763532) is (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine.
What is the SMILES notation for (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine?
The canonical SMILES for (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine is CCOC1(C(N)c2cc(C)ccc2OC)CCCCC1.
What is the InChIKey of (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine?
The InChIKey is UVZUVGURDZOUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-4-20-17(10-6-5-7-11-17)16(18)14-12-13(2)8-9-15(14)19-3/h8-9,12,16H,4-7,10-11,18H2,1-3H3.
What are the key properties of (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine?
(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine has a molecular weight of 277.41 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine is sourced from PubChem (CID 116763532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).