N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine

C15H23NO — CID 81018226

IUPACN-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine
SMILESCCNCC1CCC1Cc1ccccc1OC
InChIInChI=1S/C15H23NO/c1-3-16-11-14-9-8-12(14)10-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyZHGUDUDECDXHFB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.87
Rot. Bonds6

About N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine

N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine (PubChem CID 81018226) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine
PubChem CID81018226
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine
SMILESCCNCC1CCC1Cc1ccccc1OC
InChIInChI=1S/C15H23NO/c1-3-16-11-14-9-8-12(14)10-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyZHGUDUDECDXHFB-UHFFFAOYSA-N
XLogP2.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-[(2-methoxyphenyl)methyl]cyclohexyl]methyl]ethanamine
CID 81028833
N-[[2-[(2-methoxyphenyl)methyl]cyclopentyl]methyl]propan-1-amine
CID 81034455
N-[[2-[(5-bromo-2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine
CID 81017189
N-[[2-[(2-methylphenyl)methyl]cyclobutyl]methyl]ethanamine
CID 81017088
N-[[2-[(2-methoxy-5-methylphenyl)methyl]cyclopentyl]methyl]ethanamine
CID 81033186
N-[[2-[(2-methoxyphenyl)methyl]cycloheptyl]methyl]propan-2-amine
CID 81034896
1-[4-ethyl-2-[(2-methoxyphenyl)methyl]cyclohexyl]-N-methylmethanamine
CID 81032383
N-[[2-[(2-methylphenyl)methyl]cyclopentyl]methyl]ethanamine
CID 81033027
N-[[2-(2-methoxyphenyl)cyclopropyl]methyl]ethanamine
CID 62704571
N-[[2-[(2,4-difluorophenyl)methyl]cyclobutyl]methyl]ethanamine
CID 81017187
N-[[2-[(5-bromo-2-methoxyphenyl)methyl]cyclobutyl]methyl]propan-1-amine
CID 81018146
1-methoxy-2-[(4-propylcyclohexyl)methyl]benzene
CID 141394597

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine?
The IUPAC name of N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine (CID 81018226) is N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine?
The canonical SMILES for N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine is CCNCC1CCC1Cc1ccccc1OC.
What is the InChIKey of N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine?
The InChIKey is ZHGUDUDECDXHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-16-11-14-9-8-12(14)10-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3.
What are the key properties of N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine?
N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(2-methoxyphenyl)methyl]cyclobutyl]methyl]ethanamine is sourced from PubChem (CID 81018226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).