5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine

C15H25NO — CID 65303647

IUPAC5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine
SMILESCNCCC(C)CCc1cc(C)ccc1OC
InChIInChI=1S/C15H25NO/c1-12(9-10-16-3)5-7-14-11-13(2)6-8-15(14)17-4/h6,8,11-12,16H,5,7,9-10H2,1-4H3
InChIKeyMACWKZFUEZIUNL-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.18
Rot. Bonds7

About 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine

5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine (PubChem CID 65303647) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine
PubChem CID65303647
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine
SMILESCNCCC(C)CCc1cc(C)ccc1OC
InChIInChI=1S/C15H25NO/c1-12(9-10-16-3)5-7-14-11-13(2)6-8-15(14)17-4/h6,8,11-12,16H,5,7,9-10H2,1-4H3
InChIKeyMACWKZFUEZIUNL-UHFFFAOYSA-N
XLogP3.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,5-dimethylphenyl)-N,3-dimethylpentan-1-amine
CID 65304462
4-(2-methoxy-5-methylphenyl)-2-methyl-N-(2-methylpropyl)butan-1-amine
CID 64666050
1-(2-methoxy-5-methylphenyl)-N,4-dimethylpentan-3-amine
CID 55041605
5-(5-bromo-2-methoxy-4-methylphenyl)-N,3-dimethylpentan-1-amine
CID 65433204
5-(4-methoxy-3-methylphenyl)-N,3-dimethylpentan-1-amine
CID 65303977
5-(3,4-dimethoxyphenyl)-N,3-dimethylpentan-1-amine
CID 65304508
5-(2,5-dimethoxyphenyl)-N-ethyl-3-methylpentan-1-amine
CID 65304513
butane;1-methoxy-4-methyl-2-(2-methylbutyl)benzene
CID 144898289
4-amino-1-(2-methoxy-5-methylphenyl)pentan-3-ol
CID 83933089
1-(2-methoxy-5-methylphenyl)-N-propylhexan-3-amine
CID 62160648
3-(2-methoxy-5-methylphenyl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62529285
5-(2-methoxy-5-methylphenyl)pentan-2-amine
CID 64505046

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine?
The IUPAC name of 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine (CID 65303647) is 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine.
What is the SMILES notation for 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine?
The canonical SMILES for 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine is CNCCC(C)CCc1cc(C)ccc1OC.
What is the InChIKey of 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine?
The InChIKey is MACWKZFUEZIUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-12(9-10-16-3)5-7-14-11-13(2)6-8-15(14)17-4/h6,8,11-12,16H,5,7,9-10H2,1-4H3.
What are the key properties of 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine?
5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-5-methylphenyl)-N,3-dimethylpentan-1-amine is sourced from PubChem (CID 65303647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).