N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine

C14H21NO2 — CID 113439757

IUPACN-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine
SMILESCCNC1CC(Oc2ccc(C)cc2)C1OC
InChIInChI=1S/C14H21NO2/c1-4-15-12-9-13(14(12)16-3)17-11-7-5-10(2)6-8-11/h5-8,12-15H,4,9H2,1-3H3
InChIKeyQEVLQDWJNXSSFQ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.14
Rot. Bonds5

About N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine

N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine (PubChem CID 113439757) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine
PubChem CID113439757
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine
SMILESCCNC1CC(Oc2ccc(C)cc2)C1OC
InChIInChI=1S/C14H21NO2/c1-4-15-12-9-13(14(12)16-3)17-11-7-5-10(2)6-8-11/h5-8,12-15H,4,9H2,1-3H3
InChIKeyQEVLQDWJNXSSFQ-UHFFFAOYSA-N
XLogP2.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-methoxy-3-(4-propoxyphenoxy)cyclobutan-1-amine
CID 104674553
N-ethyl-2-methoxy-3-(3-methyl-4-nitrophenoxy)cyclobutan-1-amine
CID 104674218
3-(3-chloro-4-nitrophenoxy)-N-ethyl-2-methoxycyclobutan-1-amine
CID 104674795
4-tert-butyl-N-ethyl-2-(4-methylphenoxy)cyclohexan-1-amine
CID 63474008
N-ethyl-3-(4-fluoro-2-methylphenoxy)-2-methoxycyclobutan-1-amine
CID 113439838
1-(3-chloro-2-methoxycyclobutyl)oxy-4-methylbenzene
CID 104673868
N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine
CID 107388346
3-(4-bromo-3-methylphenoxy)-2-methoxy-N-propylcyclobutan-1-amine
CID 104675018
3-(3,5-dimethylphenoxy)-N-ethyl-2-propoxycyclobutan-1-amine
CID 107943234
3-(3,4-difluorophenoxy)-2-ethoxy-N-ethylcyclobutan-1-amine
CID 104676375
3-(4-bromo-2-fluorophenoxy)-N-ethyl-2-methoxycyclobutan-1-amine
CID 113439779
2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine
CID 104674319

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine?
The IUPAC name of N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine (CID 113439757) is N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine.
What is the SMILES notation for N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine?
The canonical SMILES for N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine is CCNC1CC(Oc2ccc(C)cc2)C1OC.
What is the InChIKey of N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine?
The InChIKey is QEVLQDWJNXSSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-15-12-9-13(14(12)16-3)17-11-7-5-10(2)6-8-11/h5-8,12-15H,4,9H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine?
N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine has a molecular weight of 235.33 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-3-(4-methylphenoxy)cyclobutan-1-amine is sourced from PubChem (CID 113439757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).