2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine

C20H27N — CID 81429025

IUPAC2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine
SMILESCNC(CC1CCCCC1)c1c(C)ccc2ccccc12
InChIInChI=1S/C20H27N/c1-15-12-13-17-10-6-7-11-18(17)20(15)19(21-2)14-16-8-4-3-5-9-16/h6-7,10-13,16,19,21H,3-5,8-9,14H2,1-2H3
InChIKeyMYHYLAWVOODVAO-UHFFFAOYSA-N
MW281.44 g/mol
LogP5.38
Rot. Bonds4

About 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine

2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine (PubChem CID 81429025) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine
PubChem CID81429025
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC Name2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine
SMILESCNC(CC1CCCCC1)c1c(C)ccc2ccccc12
InChIInChI=1S/C20H27N/c1-15-12-13-17-10-6-7-11-18(17)20(15)19(21-2)14-16-8-4-3-5-9-16/h6-7,10-13,16,19,21H,3-5,8-9,14H2,1-2H3
InChIKeyMYHYLAWVOODVAO-UHFFFAOYSA-N
XLogP5.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.44
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-N-ethyl-1-(2-methylnaphthalen-1-yl)ethanamine
CID 81429431
1-[bromo(cyclohexyl)methyl]-2-methylnaphthalene
CID 81432915
3-cyclohexyl-1-(2-methylnaphthalen-1-yl)propan-1-amine
CID 81430295
N,4-dimethyl-1-(2-methylnaphthalen-1-yl)pentan-1-amine
CID 81432711
1-(1-bromo-2-cyclopropylethyl)-2-methylnaphthalene
CID 81432823
2-cyclobutyl-N-methyl-1-(4-methylquinolin-2-yl)ethanamine
CID 114755199
2-cycloheptyl-N-methyl-1-(7-methyl-1-benzofuran-2-yl)ethanamine
CID 105045483
1-(1-benzothiophen-3-yl)-2-cyclohexyl-N-methylethanamine
CID 43485761
2-cyclohexyl-N-ethyl-1-naphthalen-1-ylethanamine
CID 63416140
1-(3-chloro-4-methylphenyl)-2-cyclohexyl-N-methylethanamine
CID 115842241
2-cyclobutyl-N-methyl-1-(2,3,4,5,6-pentamethylphenyl)ethanamine
CID 103162796
2-cycloheptyl-N-methyl-1-(3-methylphenyl)ethanamine
CID 115789919

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine (CID 81429025) is 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine is CNC(CC1CCCCC1)c1c(C)ccc2ccccc12.
What is the InChIKey of 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine?
The InChIKey is MYHYLAWVOODVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-15-12-13-17-10-6-7-11-18(17)20(15)19(21-2)14-16-8-4-3-5-9-16/h6-7,10-13,16,19,21H,3-5,8-9,14H2,1-2H3.
What are the key properties of 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine?
2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine has a molecular weight of 281.44 g/mol, XLogP of 5.38, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methyl-1-(2-methylnaphthalen-1-yl)ethanamine is sourced from PubChem (CID 81429025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).