2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol

C11H17NO2 — CID 22961263

IUPAC2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol
SMILESCOc1ccc(CC(C)(N)CO)cc1
InChIInChI=1S/C11H17NO2/c1-11(12,8-13)7-9-3-5-10(14-2)6-4-9/h3-6,13H,7-8,12H2,1-2H3
InChIKeyFNUMSYUSWLPIJJ-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.95
Rot. Bonds4

About 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol

2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol (PubChem CID 22961263) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol
PubChem CID22961263
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol
SMILESCOc1ccc(CC(C)(N)CO)cc1
InChIInChI=1S/C11H17NO2/c1-11(12,8-13)7-9-3-5-10(14-2)6-4-9/h3-6,13H,7-8,12H2,1-2H3
InChIKeyFNUMSYUSWLPIJJ-UHFFFAOYSA-N
XLogP0.95
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-iodophenyl)-3-(4-methoxyphenyl)-2-methylpropan-2-amine
CID 65477669
1,2-bis(4-methoxyphenyl)propan-2-amine
CID 63273092
3-(4-methoxyphenyl)-2,2-dimethylpropanamide
CID 131843624
1-(4-methoxyphenyl)-2-N',2-N'-dimethylpropane-2,2-diamine
CID 84748167
(2R)-2-amino-4-[4-[3-(4-methoxyphenyl)propoxy]phenyl]-2-methylbutan-1-ol
CID 59655604
1-(2,6-difluorophenyl)-3-(4-methoxyphenyl)-2-methylpropan-2-amine
CID 114931245
2-[(4-methoxyphenyl)methyl]-2-(methylamino)propane-1,3-diol
CID 121015626
2-amino-3-(4-methoxyphenyl)-2-methylpropanenitrile
CID 14989929
[2-(hydroxymethyl)-3-(4-methoxyphenyl)-2-methylpropyl] acetate
CID 101271148
1-(4-methoxyphenyl)-2-methyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824884
2-amino-4-(4-methoxyphenoxy)-2-methylpentan-1-ol
CID 64802307
1-(3-bromo-4-fluorophenyl)-3-(4-methoxyphenyl)-2-methylpropan-2-amine
CID 63273009

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol?
The IUPAC name of 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol (CID 22961263) is 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol?
The canonical SMILES for 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol is COc1ccc(CC(C)(N)CO)cc1.
What is the InChIKey of 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol?
The InChIKey is FNUMSYUSWLPIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-11(12,8-13)7-9-3-5-10(14-2)6-4-9/h3-6,13H,7-8,12H2,1-2H3.
What are the key properties of 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol?
2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol has a molecular weight of 195.26 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(4-methoxyphenyl)-2-methylpropan-1-ol is sourced from PubChem (CID 22961263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).