1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine

C17H27NO — CID 116773025

IUPAC1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine
SMILESCCNC(C1CCCCC1)C(OC)c1ccccc1
InChIInChI=1S/C17H27NO/c1-3-18-16(14-10-6-4-7-11-14)17(19-2)15-12-8-5-9-13-15/h5,8-9,12-14,16-18H,3-4,6-7,10-11H2,1-2H3
InChIKeyUAKGHHCALUKHCI-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.93
Rot. Bonds6

About 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine

1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine (PubChem CID 116773025) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine
PubChem CID116773025
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine
SMILESCCNC(C1CCCCC1)C(OC)c1ccccc1
InChIInChI=1S/C17H27NO/c1-3-18-16(14-10-6-4-7-11-14)17(19-2)15-12-8-5-9-13-15/h5,8-9,12-14,16-18H,3-4,6-7,10-11H2,1-2H3
InChIKeyUAKGHHCALUKHCI-UHFFFAOYSA-N
XLogP3.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-2-methoxy-2-phenylethanol
CID 116756943
1-cyclobutyl-N-ethyl-2-phenylbutan-1-amine
CID 105049307
1,2-dicyclohexyl-N-ethyl-2-methoxyethanamine
CID 116771642
3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine
CID 116773746
N-[cyclobutyl(phenyl)methyl]ethanamine
CID 43489136
2-methoxy-N-methyl-1-(4-methylcyclohexyl)-2-phenylethanamine
CID 116772639
(1-cyclopentyl-2-ethoxy-2-phenylethyl)hydrazine
CID 105279234
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
CID 60797775
ethyl (2S,3S)-2-(cyclopentylamino)-3-methoxy-3-phenylpropanoate
CID 71740166
1-methoxy-1-phenyl-N-propylpropan-2-amine
CID 116773234
N-[cyclohexyl(phenyl)methyl]-2-methoxy-2-methylpropan-1-amine
CID 104759566
(1-cyclohexyl-3-methyl-2-phenylpentyl)hydrazine
CID 105282072

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine?
The IUPAC name of 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine (CID 116773025) is 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine?
The canonical SMILES for 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine is CCNC(C1CCCCC1)C(OC)c1ccccc1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine?
The InChIKey is UAKGHHCALUKHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-3-18-16(14-10-6-4-7-11-14)17(19-2)15-12-8-5-9-13-15/h5,8-9,12-14,16-18H,3-4,6-7,10-11H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine?
1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine is sourced from PubChem (CID 116773025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).