N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine

C18H21NO — CID 63551846

IUPACN-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
SMILESCNCc1ccccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H21NO/c1-19-13-16-8-4-5-9-18(16)20-17-11-10-14-6-2-3-7-15(14)12-17/h4-5,8-12,19H,2-3,6-7,13H2,1H3
InChIKeyJGFHVVITJLOERD-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.08
Rot. Bonds4

About N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine

N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine (PubChem CID 63551846) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
PubChem CID63551846
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
SMILESCNCc1ccccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H21NO/c1-19-13-16-8-4-5-9-18(16)20-17-11-10-14-6-2-3-7-15(14)12-17/h4-5,8-12,19H,2-3,6-7,13H2,1H3
InChIKeyJGFHVVITJLOERD-UHFFFAOYSA-N
XLogP4.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
CID 63552028
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine
CID 43283537
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]cyclopropanamine
CID 43283536
1-[2-(2,3-dihydro-1-benzothiophen-5-yloxy)phenyl]-N-methylmethanamine
CID 141048003
1-[3-chloro-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-N-methylmethanamine
CID 81152018
1-[2-(1,3-benzodioxol-5-yloxy)phenyl]-N-methylmethanamine
CID 43282413
1-[3-(2,3-dihydro-1H-inden-5-yloxy)phenyl]-N-methylmethanamine
CID 63942120
2-methyl-4-[2-(methylaminomethyl)phenoxy]benzonitrile
CID 106485293
2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)benzaldehyde
CID 55224942
1-[2-(2-ethylphenoxy)phenyl]-N-methylmethanamine
CID 43283795
N-methyl-1-[2-(4-nitrophenoxy)phenyl]methanamine
CID 54915610
N-[[3-chloro-4-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]ethanamine
CID 81152008

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine?
The IUPAC name of N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine (CID 63551846) is N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine is CNCc1ccccc1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine?
The InChIKey is JGFHVVITJLOERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-19-13-16-8-4-5-9-18(16)20-17-11-10-14-6-2-3-7-15(14)12-17/h4-5,8-12,19H,2-3,6-7,13H2,1H3.
What are the key properties of N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine?
N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine has a molecular weight of 267.37 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine is sourced from PubChem (CID 63551846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).