N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C17H25NO2 — CID 103921144

IUPACN-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCOC1CC(NC2CCCc3cc(OC)ccc32)C1
InChIInChI=1S/C17H25NO2/c1-3-20-15-10-13(11-15)18-17-6-4-5-12-9-14(19-2)7-8-16(12)17/h7-9,13,15,17-18H,3-6,10-11H2,1-2H3
InChIKeyDIPKQSGLWLHNRQ-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.23
Rot. Bonds5

About N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 103921144) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID103921144
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCOC1CC(NC2CCCc3cc(OC)ccc32)C1
InChIInChI=1S/C17H25NO2/c1-3-20-15-10-13(11-15)18-17-6-4-5-12-9-14(19-2)7-8-16(12)17/h7-9,13,15,17-18H,3-6,10-11H2,1-2H3
InChIKeyDIPKQSGLWLHNRQ-UHFFFAOYSA-N
XLogP3.23
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethoxycyclobutyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 103917688
N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43190307
2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
CID 3016750
N-cyclobutyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79239587
N-cyclohexyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79239408
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
CID 78319340
3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 43206577
6-methoxy-N-(2-methoxy-2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115728733
3-[[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl]pentan-3-ol
CID 65105549
N,N-diethyl-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide
CID 115712646
ethyl 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanoate
CID 61498112
N-(dicyclopropylmethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43096402

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 103921144) is N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is CCOC1CC(NC2CCCc3cc(OC)ccc32)C1.
What is the InChIKey of N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is DIPKQSGLWLHNRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-3-20-15-10-13(11-15)18-17-6-4-5-12-9-14(19-2)7-8-16(12)17/h7-9,13,15,17-18H,3-6,10-11H2,1-2H3.
What are the key properties of N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 275.39 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxycyclobutyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 103921144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).