2-(2-methoxyphenyl)hexan-1-amine

C13H21NO — CID 84753039

IUPAC2-(2-methoxyphenyl)hexan-1-amine
SMILESCCCCC(CN)c1ccccc1OC
InChIInChI=1S/C13H21NO/c1-3-4-7-11(10-14)12-8-5-6-9-13(12)15-2/h5-6,8-9,11H,3-4,7,10,14H2,1-2H3
InChIKeyAWORVAHHPJYQIS-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.93
Rot. Bonds6

About 2-(2-methoxyphenyl)hexan-1-amine

2-(2-methoxyphenyl)hexan-1-amine (PubChem CID 84753039) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)hexan-1-amine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)hexan-1-amine
PubChem CID84753039
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name2-(2-methoxyphenyl)hexan-1-amine
SMILESCCCCC(CN)c1ccccc1OC
InChIInChI=1S/C13H21NO/c1-3-4-7-11(10-14)12-8-5-6-9-13(12)15-2/h5-6,8-9,11H,3-4,7,10,14H2,1-2H3
InChIKeyAWORVAHHPJYQIS-UHFFFAOYSA-N
XLogP2.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-butoxy-4-methoxyphenyl)-2-(2-methoxyphenyl)propan-1-amine
CID 83974356
1-(1-ethoxypentyl)-2-methoxybenzene
CID 141341766
2-(2-methylphenyl)decan-1-amine
CID 79421405
2-(2-chlorophenyl)nonan-1-amine
CID 79448666
2-(2-methoxyphenyl)-3-(2,4,6-trimethylphenyl)propan-1-amine
CID 82141447
1-(2-methoxyphenyl)-N,2-dimethylhexan-1-amine
CID 114246284
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599
1-[bis(propylsulfanyl)methyl]-2-methoxybenzene
CID 15503381
3-(2-methoxyphenyl)pentane-1,5-diol
CID 51050570
(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
2-amino-1-(2-methoxyphenyl)ethanol;hydrochloride
CID 54593518
[5-acetyloxy-3-(2-methoxyphenyl)pentyl] acetate
CID 51050664

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)hexan-1-amine?
The IUPAC name of 2-(2-methoxyphenyl)hexan-1-amine (CID 84753039) is 2-(2-methoxyphenyl)hexan-1-amine.
What is the SMILES notation for 2-(2-methoxyphenyl)hexan-1-amine?
The canonical SMILES for 2-(2-methoxyphenyl)hexan-1-amine is CCCCC(CN)c1ccccc1OC.
What is the InChIKey of 2-(2-methoxyphenyl)hexan-1-amine?
The InChIKey is AWORVAHHPJYQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-4-7-11(10-14)12-8-5-6-9-13(12)15-2/h5-6,8-9,11H,3-4,7,10,14H2,1-2H3.
What are the key properties of 2-(2-methoxyphenyl)hexan-1-amine?
2-(2-methoxyphenyl)hexan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)hexan-1-amine is sourced from PubChem (CID 84753039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).