N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine

C18H27NO — CID 65455366

IUPACN-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCNC1CCCc2c(OC3CCCC(C)C3)cccc21
InChIInChI=1S/C18H27NO/c1-13-6-3-7-14(12-13)20-18-11-5-8-15-16(18)9-4-10-17(15)19-2/h5,8,11,13-14,17,19H,3-4,6-7,9-10,12H2,1-2H3
InChIKeyFWQWZZMMEGRGQD-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.24
Rot. Bonds3

About N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine

N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 65455366) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID65455366
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC NameN-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCNC1CCCc2c(OC3CCCC(C)C3)cccc21
InChIInChI=1S/C18H27NO/c1-13-6-3-7-14(12-13)20-18-11-5-8-15-16(18)9-4-10-17(15)19-2/h5,8,11,13-14,17,19H,3-4,6-7,9-10,12H2,1-2H3
InChIKeyFWQWZZMMEGRGQD-UHFFFAOYSA-N
XLogP4.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclohex-2-en-1-yloxy-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114619851
5-(methoxymethoxy)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65455743
5-(3-methylcyclohexyl)oxy-3,4-dihydro-2H-naphthalen-1-one
CID 65455951
5-(3,5-dimethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65453836
5-butoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65455547
N-methyl-5-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65456122
4-[[5-(methylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]butan-1-ol
CID 65456677
N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65455735
N-methyl-5-(pyridin-4-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65456675
2-methyl-1-[[5-(methylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]butan-2-ol
CID 114492127
5-[(2-bromophenyl)methoxy]-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65456121
1-methoxy-3-[[5-(methylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]propan-2-ol
CID 65455364

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 65455366) is N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine is CNC1CCCc2c(OC3CCCC(C)C3)cccc21.
What is the InChIKey of N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is FWQWZZMMEGRGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-13-6-3-7-14(12-13)20-18-11-5-8-15-16(18)9-4-10-17(15)19-2/h5,8,11,13-14,17,19H,3-4,6-7,9-10,12H2,1-2H3.
What are the key properties of N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 273.42 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(3-methylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 65455366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).