1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine

C15H17NO2 — CID 82552149

IUPAC1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(Oc2ccccc2)ccc1OC
InChIInChI=1S/C15H17NO2/c1-16-11-12-10-14(8-9-15(12)17-2)18-13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3
InChIKeyCUKSOFBSQFKTHM-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.21
Rot. Bonds5

About 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine

1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine (PubChem CID 82552149) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine
PubChem CID82552149
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(Oc2ccccc2)ccc1OC
InChIInChI=1S/C15H17NO2/c1-16-11-12-10-14(8-9-15(12)17-2)18-13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3
InChIKeyCUKSOFBSQFKTHM-UHFFFAOYSA-N
XLogP3.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-methoxy-5-[(E)-2-phenylethenyl]phenyl]-N-methylmethanamine
CID 56707768
1-[5-fluoro-2-(2-methoxyphenoxy)phenyl]-N-methylmethanamine
CID 43314262
2-(2-ethoxy-5-phenoxyphenyl)-N-methylethanamine
CID 82552147
(2S,3S)-N-[(2-methoxy-5-phenoxyphenyl)methyl]-2-phenylpiperidin-3-amine;hydrochloride
CID 70200380
4-methoxy-3-(methylaminomethyl)phenol
CID 84731678
4-methoxy-3-(methylaminomethyl)aniline
CID 21415904
1-(2-ethoxy-5-methoxyphenyl)-N-methylmethanamine
CID 43276259
1-[5-chloro-2-(4-methoxyphenoxy)phenyl]-N-methylmethanamine
CID 114855838
1-[(2,5-dimethoxyphenyl)methyl]-2-phenylhydrazine
CID 169384341
ethane;1-ethyl-2-methoxy-4-phenoxybenzene;propane
CID 142071231
1-[2-[(2-bromophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880406
1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880037

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine (CID 82552149) is 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine is CNCc1cc(Oc2ccccc2)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine?
The InChIKey is CUKSOFBSQFKTHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-16-11-12-10-14(8-9-15(12)17-2)18-13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3.
What are the key properties of 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine?
1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine has a molecular weight of 243.31 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 82552149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).