methane;(1R)-1-(3-methoxyphenyl)ethanamine

C10H17NO — CID 160746722

IUPACmethane;(1R)-1-(3-methoxyphenyl)ethanamine
SMILESC.COc1cccc([C@@H](C)N)c1
InChIInChI=1S/C9H13NO.CH4/c1-7(10)8-4-3-5-9(6-8)11-2;/h3-7H,10H2,1-2H3;1H4/t7-;/m1./s1
InChIKeyRWGYLBHLYSYUNE-OGFXRTJISA-N
MW167.25 g/mol
LogP2.35
Rot. Bonds2

About methane;(1R)-1-(3-methoxyphenyl)ethanamine

methane;(1R)-1-(3-methoxyphenyl)ethanamine (PubChem CID 160746722) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is methane;(1R)-1-(3-methoxyphenyl)ethanamine.

Molecular Properties

Compound Namemethane;(1R)-1-(3-methoxyphenyl)ethanamine
PubChem CID160746722
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Namemethane;(1R)-1-(3-methoxyphenyl)ethanamine
SMILESC.COc1cccc([C@@H](C)N)c1
InChIInChI=1S/C9H13NO.CH4/c1-7(10)8-4-3-5-9(6-8)11-2;/h3-7H,10H2,1-2H3;1H4/t7-;/m1./s1
InChIKeyRWGYLBHLYSYUNE-OGFXRTJISA-N
XLogP2.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methoxyphenyl)ethanamine;hydrochloride
CID 19864848
(1S)-1-[3-(3-methoxyphenyl)phenyl]ethanamine
CID 93461021
1-[3-(4-methoxyphenoxy)phenyl]ethanamine
CID 79016052
2-[3-(1-aminoethyl)phenoxy]-1-(3-methoxyphenyl)ethanol
CID 81134404
1-methoxy-3-[3-(3-methoxyphenyl)butan-2-yl]benzene
CID 12861418
1-(3-methoxyphenyl)-2,3-dimethylbutan-1-amine
CID 115785901
1-[3-[(4-methoxyphenyl)methoxy]phenyl]ethanamine
CID 60879205
1-[3-(5-methoxy-2-nitrophenoxy)phenyl]ethanamine
CID 102702770
1-[3-(4-methoxy-2-nitrophenoxy)phenyl]ethanamine
CID 79166618
2-(3-methoxyphenyl)-1-phenylpropan-1-amine
CID 57276567
(1R)-1-[3-bromo-4-(3-methoxyphenoxy)phenyl]ethanamine
CID 78937846
1-[3-bromo-4-(3-methoxyphenoxy)phenyl]ethanamine
CID 62911214

Frequently Asked Questions

What is the IUPAC name of methane;(1R)-1-(3-methoxyphenyl)ethanamine?
The IUPAC name of methane;(1R)-1-(3-methoxyphenyl)ethanamine (CID 160746722) is methane;(1R)-1-(3-methoxyphenyl)ethanamine.
What is the SMILES notation for methane;(1R)-1-(3-methoxyphenyl)ethanamine?
The canonical SMILES for methane;(1R)-1-(3-methoxyphenyl)ethanamine is C.COc1cccc([C@@H](C)N)c1.
What is the InChIKey of methane;(1R)-1-(3-methoxyphenyl)ethanamine?
The InChIKey is RWGYLBHLYSYUNE-OGFXRTJISA-N. The full InChI is InChI=1S/C9H13NO.CH4/c1-7(10)8-4-3-5-9(6-8)11-2;/h3-7H,10H2,1-2H3;1H4/t7-;/m1./s1.
What are the key properties of methane;(1R)-1-(3-methoxyphenyl)ethanamine?
methane;(1R)-1-(3-methoxyphenyl)ethanamine has a molecular weight of 167.25 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;(1R)-1-(3-methoxyphenyl)ethanamine is sourced from PubChem (CID 160746722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).