1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine

C14H23NO — CID 61066103

IUPAC1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccccc1OC)CC(C)C
InChIInChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-7-5-6-8-14(12)16-4/h5-8,11,13,15H,9-10H2,1-4H3
InChIKeyYAOMOBYCNSONNC-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.87
Rot. Bonds6

About 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine

1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine (PubChem CID 61066103) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine
PubChem CID61066103
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccccc1OC)CC(C)C
InChIInChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-7-5-6-8-14(12)16-4/h5-8,11,13,15H,9-10H2,1-4H3
InChIKeyYAOMOBYCNSONNC-UHFFFAOYSA-N
XLogP2.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-methoxyphenyl)propan-2-yl]-2,6-dimethylheptan-4-amine
CID 63452997
1-(2-methoxyphenyl)-N-methyl-3-methylsulfanylpropan-2-amine
CID 62692992
1-(2-methoxyphenyl)-N,5,5-trimethylhexan-2-amine
CID 62601026
1-(2-methoxyphenyl)-N-methyl-3-methylsulfonylpropan-2-amine
CID 62473638
2-[(2-methoxyphenyl)methyl]-4-methyl-N-(2-methylpropyl)pentan-1-amine
CID 63498326
1-(2-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propan-2-amine
CID 61262537
4-ethyl-1-(2-methoxyphenyl)-N-propylhexan-2-amine
CID 82922595
1-(2-methoxyphenyl)-N-methyl-3-phenylsulfanylpropan-2-amine
CID 65142417
1-(2-methoxyphenyl)-4,5,5-trimethyl-N-propylhexan-2-amine
CID 63833464
1-(2-methoxyphenyl)-3-methylsulfanyl-N-propylpropan-2-amine
CID 55108619
1-(2-methoxyphenyl)-N-methyl-3-(1-methyltriazol-4-yl)propan-2-amine
CID 107048713
1-(2-methoxyphenyl)-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 65131449

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine (CID 61066103) is 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine is CNC(Cc1ccccc1OC)CC(C)C.
What is the InChIKey of 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The InChIKey is YAOMOBYCNSONNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-7-5-6-8-14(12)16-4/h5-8,11,13,15H,9-10H2,1-4H3.
What are the key properties of 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine?
1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine has a molecular weight of 221.34 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 1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine is sourced from PubChem (CID 61066103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).