N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

C16H23NO2 — CID 65455735

IUPACN-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCNC1CCCc2c(OCC3CCCO3)cccc21
InChIInChI=1S/C16H23NO2/c1-17-15-8-2-7-14-13(15)6-3-9-16(14)19-11-12-5-4-10-18-12/h3,6,9,12,15,17H,2,4-5,7-8,10-11H2,1H3
InChIKeySMCGPZQBZZEPSL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.84
Rot. Bonds4

About N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 65455735) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID65455735
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCNC1CCCc2c(OCC3CCCO3)cccc21
InChIInChI=1S/C16H23NO2/c1-17-15-8-2-7-14-13(15)6-3-9-16(14)19-11-12-5-4-10-18-12/h3,6,9,12,15,17H,2,4-5,7-8,10-11H2,1H3
InChIKeySMCGPZQBZZEPSL-UHFFFAOYSA-N
XLogP2.84
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-[3-(oxolan-2-yl)propoxy]-2,3-dihydro-1H-inden-1-amine
CID 65158985
5-(methoxymethoxy)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65455743
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-[(5-methyl-1,2-oxazol-3-yl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65454409
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
N-cyclopropyl-2-[[5-(methylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetamide
CID 65455358
5-[(3-bromophenyl)methoxy]-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65454420

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 65455735) is N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is CNC1CCCc2c(OCC3CCCO3)cccc21.
What is the InChIKey of N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is SMCGPZQBZZEPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-17-15-8-2-7-14-13(15)6-3-9-16(14)19-11-12-5-4-10-18-12/h3,6,9,12,15,17H,2,4-5,7-8,10-11H2,1H3.
What are the key properties of N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 261.37 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(oxolan-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 65455735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).