2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine

C20H31NO — CID 166262817

IUPAC2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine
SMILESCOC(CNCc1ccc2c(c1)CCCC2)C1CCCCC1
InChIInChI=1S/C20H31NO/c1-22-20(18-8-3-2-4-9-18)15-21-14-16-11-12-17-7-5-6-10-19(17)13-16/h11-13,18,20-21H,2-10,14-15H2,1H3
InChIKeyCLYMURSCKNSMLX-UHFFFAOYSA-N
MW301.47 g/mol
LogP4.25
Rot. Bonds6

About 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine

2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine (PubChem CID 166262817) has the molecular formula C20H31NO and a molecular weight of 301.47 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine
PubChem CID166262817
Molecular FormulaC20H31NO
Molecular Weight301.47 g/mol
Exact Mass301.24
IUPAC Name2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine
SMILESCOC(CNCc1ccc2c(c1)CCCC2)C1CCCCC1
InChIInChI=1S/C20H31NO/c1-22-20(18-8-3-2-4-9-18)15-21-14-16-11-12-17-7-5-6-10-19(17)13-16/h11-13,18,20-21H,2-10,14-15H2,1H3
InChIKeyCLYMURSCKNSMLX-UHFFFAOYSA-N
XLogP4.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.47
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethylamino)ethanol
CID 166350994
(1S)-1-cycloheptyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)ethanamine
CID 81391872
1-cyclohexyl-N'-(2,3-dihydro-1-benzofuran-5-ylmethyl)-N,N-dimethylethane-1,2-diamine
CID 78903432
2-[(2,3-dihydro-1H-inden-5-ylmethylamino)methyl]butan-1-ol
CID 115250760
2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol
CID 166350957
N-methyl-N'-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethane-1,2-diamine
CID 115195816
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-1-amine
CID 43163737
1-cyclohexyl-N-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethanamine
CID 104749235
2-[(2,3-dihydro-1H-inden-5-ylmethylamino)methyl]butanoic acid
CID 115249897
2-cyclopropyl-N-[(3,4-dimethoxyphenyl)methyl]propan-1-amine
CID 115592709
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-2-amine
CID 43163778
N-(2,3-dihydro-1H-inden-5-ylmethyl)-4-(2-methoxyethoxy)butan-1-amine
CID 115660085

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine?
The IUPAC name of 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine (CID 166262817) is 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine is COC(CNCc1ccc2c(c1)CCCC2)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine?
The InChIKey is CLYMURSCKNSMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO/c1-22-20(18-8-3-2-4-9-18)15-21-14-16-11-12-17-7-5-6-10-19(17)13-16/h11-13,18,20-21H,2-10,14-15H2,1H3.
What are the key properties of 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine?
2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine has a molecular weight of 301.47 g/mol, XLogP of 4.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine is sourced from PubChem (CID 166262817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).