N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine

C16H19NO — CID 54911742

IUPACN-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine
SMILESCCNCc1cccc(-c2ccccc2OC)c1
InChIInChI=1S/C16H19NO/c1-3-17-12-13-7-6-8-14(11-13)15-9-4-5-10-16(15)18-2/h4-11,17H,3,12H2,1-2H3
InChIKeyZZABGRZFZDCVBQ-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.47
Rot. Bonds5

About N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine

N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine (PubChem CID 54911742) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine
PubChem CID54911742
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine
SMILESCCNCc1cccc(-c2ccccc2OC)c1
InChIInChI=1S/C16H19NO/c1-3-17-12-13-7-6-8-14(11-13)15-9-4-5-10-16(15)18-2/h4-11,17H,3,12H2,1-2H3
InChIKeyZZABGRZFZDCVBQ-UHFFFAOYSA-N
XLogP3.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[3-(2-methoxyphenyl)phenyl]methyl]propan-1-amine
CID 54911743
3-[3-(ethylaminomethyl)phenyl]-4-methoxybenzonitrile
CID 106951070
N-[(3-phenylphenyl)methyl]ethanamine
CID 54178417
N-[[3-fluoro-4-(2-methoxyphenyl)phenyl]methyl]ethanamine
CID 81447834
N-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-1-[3-(2-methoxyphenyl)phenyl]methanamine
CID 16672060
1-cyclopropyl-N-[[3-(4-fluoro-2-methoxyphenyl)phenyl]methyl]methanamine
CID 72943652
N-[[3-(2,3-difluorophenyl)phenyl]methyl]ethanamine
CID 63989003
N-[[3-(2,4-dimethoxyphenyl)phenyl]methyl]propan-1-amine
CID 61034037
N-[[4-(2-methoxyphenyl)phenyl]methyl]propan-1-amine
CID 54911552
N-[[3-(2,3-difluoro-4-methylphenyl)phenyl]methyl]ethanamine
CID 107514099
2-[3-(hydroxymethyl)phenyl]-7-methoxycyclohepta-2,4,6-trien-1-one
CID 10633905
N-[[3-(4-bromothiophen-3-yl)phenyl]methyl]ethanamine
CID 79601644

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine?
The IUPAC name of N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine (CID 54911742) is N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine?
The canonical SMILES for N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine is CCNCc1cccc(-c2ccccc2OC)c1.
What is the InChIKey of N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine?
The InChIKey is ZZABGRZFZDCVBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-17-12-13-7-6-8-14(11-13)15-9-4-5-10-16(15)18-2/h4-11,17H,3,12H2,1-2H3.
What are the key properties of N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine?
N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine is sourced from PubChem (CID 54911742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).