1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine

C15H23NO — CID 64997584

IUPAC1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine
SMILESCCC1CC(CNC)(c2ccc(OC)cc2)C1
InChIInChI=1S/C15H23NO/c1-4-12-9-15(10-12,11-16-2)13-5-7-14(17-3)8-6-13/h5-8,12,16H,4,9-11H2,1-3H3
InChIKeyJOFRNYISPDZBCB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.97
Rot. Bonds5

About 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine

1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine (PubChem CID 64997584) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine
PubChem CID64997584
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine
SMILESCCC1CC(CNC)(c2ccc(OC)cc2)C1
InChIInChI=1S/C15H23NO/c1-4-12-9-15(10-12,11-16-2)13-5-7-14(17-3)8-6-13/h5-8,12,16H,4,9-11H2,1-3H3
InChIKeyJOFRNYISPDZBCB-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-ethyl-1-(3-methoxy-4-methylphenyl)cyclobutyl]-N-methylmethanamine
CID 64998176
N-[[1-(4-ethoxyphenyl)-3-ethylcyclobutyl]methyl]propan-2-amine
CID 64997706
1-[1-(4-chlorophenyl)-3-propylcyclobutyl]-N-methylmethanamine
CID 65013757
N-[[3-ethyl-1-(4-methylphenyl)cyclobutyl]methyl]ethanamine
CID 64997601
N-methyl-1-[1-(4-propoxyphenyl)cyclopropyl]methanamine
CID 112517810
2-ethyl-1-(4-methoxyphenyl)cyclopropan-1-ol
CID 79332791
N-[[1-(4-methoxyphenyl)cycloheptyl]methyl]ethanamine
CID 62596968
N-[(3-ethyl-1-pyridin-4-ylcyclobutyl)methyl]ethanamine
CID 80525440
N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]formamide
CID 110477111
N-[[1-(4-methoxyphenyl)cycloheptyl]methyl]propan-1-amine
CID 63516352
N-[[1-(3,4-dimethylphenyl)-3-ethylcyclobutyl]methyl]propan-1-amine
CID 64999693
N-[[1-(4-methoxyphenyl)cycloheptyl]methyl]cyclopropanamine
CID 62595322

Frequently Asked Questions

What is the IUPAC name of 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine?
The IUPAC name of 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine (CID 64997584) is 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine is CCC1CC(CNC)(c2ccc(OC)cc2)C1.
What is the InChIKey of 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine?
The InChIKey is JOFRNYISPDZBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-4-12-9-15(10-12,11-16-2)13-5-7-14(17-3)8-6-13/h5-8,12,16H,4,9-11H2,1-3H3.
What are the key properties of 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine?
1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-ethyl-1-(4-methoxyphenyl)cyclobutyl]-N-methylmethanamine is sourced from PubChem (CID 64997584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).