2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine

C16H23NO2 — CID 104674500

IUPAC2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
SMILESCNC1CC(OC2CCCc3ccccc32)C1OC
InChIInChI=1S/C16H23NO2/c1-17-13-10-15(16(13)18-2)19-14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,13-17H,5,7,9-10H2,1-2H3
InChIKeyRIUYDBOTBXNALR-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.46
Rot. Bonds4

About 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine

2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine (PubChem CID 104674500) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
PubChem CID104674500
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
SMILESCNC1CC(OC2CCCc3ccccc32)C1OC
InChIInChI=1S/C16H23NO2/c1-17-13-10-15(16(13)18-2)19-14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,13-17H,5,7,9-10H2,1-2H3
InChIKeyRIUYDBOTBXNALR-UHFFFAOYSA-N
XLogP2.46
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
CID 66357997
N,2,2-trimethyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
CID 66357591
(1R)-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1,2,3,4-tetrahydronaphthalene
CID 101156511
2,2-dimethyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-ol
CID 66366089
1-(3-chloro-2,2-diethylcyclobutyl)oxy-1,2,3,4-tetrahydronaphthalene
CID 66345937
3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol
CID 66366088
2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)oxane
CID 11085661
N-(2-methoxycyclopentyl)-2,3-dihydro-1H-inden-1-amine
CID 62086936
N-(1,2,3,4-tetrahydronaphthalen-1-yloxy)methanimine
CID 174418938
N-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 54507059
6-(3,3-dimethylbutoxy)-N-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 66234040
N-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]butan-2-amine
CID 62571109

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine (CID 104674500) is 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine is CNC1CC(OC2CCCc3ccccc32)C1OC.
What is the InChIKey of 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine?
The InChIKey is RIUYDBOTBXNALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-17-13-10-15(16(13)18-2)19-14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,13-17H,5,7,9-10H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine?
2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine has a molecular weight of 261.36 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine is sourced from PubChem (CID 104674500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).