2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol

C11H17NO2 — CID 77129779

IUPAC2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
SMILESCOc1cc(C)cc(C)c1C(N)CO
InChIInChI=1S/C11H17NO2/c1-7-4-8(2)11(9(12)6-13)10(5-7)14-3/h4-5,9,13H,6,12H2,1-3H3
InChIKeyKFRSCGPHRXEMIU-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.30
Rot. Bonds3

About 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol

2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol (PubChem CID 77129779) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol.

Molecular Properties

Compound Name2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
PubChem CID77129779
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
SMILESCOc1cc(C)cc(C)c1C(N)CO
InChIInChI=1S/C11H17NO2/c1-7-4-8(2)11(9(12)6-13)10(5-7)14-3/h4-5,9,13H,6,12H2,1-3H3
InChIKeyKFRSCGPHRXEMIU-UHFFFAOYSA-N
XLogP1.30
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[amino-(2-methoxy-4,6-dimethylphenyl)methyl]-3-methylbutan-1-ol
CID 116945650
3-amino-3-(2-methoxy-4,6-dimethylphenyl)propanenitrile
CID 116851261
1-(2-methoxy-4,6-dimethylphenyl)-2-propan-2-ylsulfanylethanamine
CID 106680616
2-amino-3-(dimethylamino)-3-(2-methoxy-4,6-dimethylphenyl)propan-1-ol
CID 116911605
N'-ethyl-1-(2-methoxy-4,6-dimethylphenyl)ethane-1,2-diamine
CID 116934935
4-amino-4-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylbutanoic acid
CID 116938518
(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol
CID 638516
ethyl 2-amino-2-(2-methoxy-4,6-dimethylphenyl)acetate
CID 3904081
2-[(1S)-1-amino-2-hydroxyethyl]-6-methoxy-4-methylphenol
CID 55277238
N'-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)ethane-1,2-diamine
CID 116935221
2-amino-2-(2-methoxy-4,5-dimethylphenyl)ethanol
CID 77129776
2-(2,4-difluorophenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanamine
CID 106680598

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol?
The IUPAC name of 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol (CID 77129779) is 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol.
What is the SMILES notation for 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol?
The canonical SMILES for 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol is COc1cc(C)cc(C)c1C(N)CO.
What is the InChIKey of 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol?
The InChIKey is KFRSCGPHRXEMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-7-4-8(2)11(9(12)6-13)10(5-7)14-3/h4-5,9,13H,6,12H2,1-3H3.
What are the key properties of 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol?
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol has a molecular weight of 195.26 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol is sourced from PubChem (CID 77129779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).