[(1R)-1-(4-methoxyphenyl)propyl]azanium

C10H16NO+ — CID 2496559

IUPAC[(1R)-1-(4-methoxyphenyl)propyl]azanium
SMILESCC[C@@H]([NH3+])c1ccc(OC)cc1
InChIInChI=1S/C10H15NO/c1-3-10(11)8-4-6-9(12-2)7-5-8/h4-7,10H,3,11H2,1-2H3/p+1/t10-/m1/s1
InChIKeyWOEIOKRLEJXFEF-SNVBAGLBSA-O
MW166.24 g/mol
LogP1.39
Rot. Bonds3

About [(1R)-1-(4-methoxyphenyl)propyl]azanium

[(1R)-1-(4-methoxyphenyl)propyl]azanium (PubChem CID 2496559) has the molecular formula C10H16NO+ and a molecular weight of 166.24 g/mol. Its IUPAC name is [(1R)-1-(4-methoxyphenyl)propyl]azanium.

Molecular Properties

Compound Name[(1R)-1-(4-methoxyphenyl)propyl]azanium
PubChem CID2496559
Molecular FormulaC10H16NO+
Molecular Weight166.24 g/mol
Exact Mass166.12
IUPAC Name[(1R)-1-(4-methoxyphenyl)propyl]azanium
SMILESCC[C@@H]([NH3+])c1ccc(OC)cc1
InChIInChI=1S/C10H15NO/c1-3-10(11)8-4-6-9(12-2)7-5-8/h4-7,10H,3,11H2,1-2H3/p+1/t10-/m1/s1
InChIKeyWOEIOKRLEJXFEF-SNVBAGLBSA-O
XLogP1.39
TPSA36.87 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methoxy-4-(3-methylpentan-2-yl)benzene
CID 138976766
[(1S)-1-(4-bromophenyl)propyl]azanium
CID 7127716
diethyl-(4-methoxyphenyl)silane
CID 102263669
1-tert-butyl-4-[(1S)-1-(4-methoxyphenyl)propyl]benzene
CID 137362247
1-methoxy-4-[1-[2-(4-methoxyphenyl)butoxy]butan-2-yl]benzene
CID 139824565
(2S)-2-(4-methoxyphenyl)butan-1-amine
CID 15215732
(1R)-1-(4-methoxyphenyl)-2-methylbutan-1-amine
CID 171200898
[(S)-cyclopropyl-(4-methoxyphenyl)methyl]azanium
CID 7557024
[(3,4-diethoxyphenyl)-(4-methoxyphenyl)methyl]azanium
CID 4712225
[(1S)-2,2-difluoro-1-(4-methoxyphenyl)ethyl]azanium
CID 28973216
1-bromo-4-[(1R,2S)-1-ethyl-2-(4-methoxyphenyl)butyl]benzene
CID 125465303
4-[(3S,4R)-4-(4-methoxyphenyl)hexan-3-yl]phenol
CID 11954178

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-(4-methoxyphenyl)propyl]azanium?
The IUPAC name of [(1R)-1-(4-methoxyphenyl)propyl]azanium (CID 2496559) is [(1R)-1-(4-methoxyphenyl)propyl]azanium.
What is the SMILES notation for [(1R)-1-(4-methoxyphenyl)propyl]azanium?
The canonical SMILES for [(1R)-1-(4-methoxyphenyl)propyl]azanium is CC[C@@H]([NH3+])c1ccc(OC)cc1.
What is the InChIKey of [(1R)-1-(4-methoxyphenyl)propyl]azanium?
The InChIKey is WOEIOKRLEJXFEF-SNVBAGLBSA-O. The full InChI is InChI=1S/C10H15NO/c1-3-10(11)8-4-6-9(12-2)7-5-8/h4-7,10H,3,11H2,1-2H3/p+1/t10-/m1/s1.
What are the key properties of [(1R)-1-(4-methoxyphenyl)propyl]azanium?
[(1R)-1-(4-methoxyphenyl)propyl]azanium has a molecular weight of 166.24 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-(4-methoxyphenyl)propyl]azanium is sourced from PubChem (CID 2496559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).