2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol

C14H19N3O2 — CID 116881587

IUPAC2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol
SMILESCOc1cc(C)cc(C)c1-c1cnc(C(N)CO)[nH]1
InChIInChI=1S/C14H19N3O2/c1-8-4-9(2)13(12(5-8)19-3)11-6-16-14(17-11)10(15)7-18/h4-6,10,18H,7,15H2,1-3H3,(H,16,17)
InChIKeySIEZMSMNXKCCOD-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.69
Rot. Bonds4

About 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol

2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol (PubChem CID 116881587) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol.

Molecular Properties

Compound Name2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol
PubChem CID116881587
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol
SMILESCOc1cc(C)cc(C)c1-c1cnc(C(N)CO)[nH]1
InChIInChI=1S/C14H19N3O2/c1-8-4-9(2)13(12(5-8)19-3)11-6-16-14(17-11)10(15)7-18/h4-6,10,18H,7,15H2,1-3H3,(H,16,17)
InChIKeySIEZMSMNXKCCOD-UHFFFAOYSA-N
XLogP1.69
TPSA84.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]butanenitrile
CID 116883164
2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]acetic acid
CID 116878624
2-(2-chloroethyl)-5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazole
CID 116878216
5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazole-2-carboxylic acid
CID 116878539
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779
6-(2-methoxy-4,6-dimethylphenyl)-2-propan-2-yl-1H-pyrimidine-4-thione
CID 106683063
2-[(1S)-1-amino-2-hydroxyethyl]-6-methoxy-4-methylphenol
CID 55277238
2-amino-2-[5-(4-chlorophenyl)-1H-imidazol-2-yl]ethanol
CID 116881536
1-[5-(2,4,6-trimethylphenyl)-1H-imidazol-2-yl]propan-2-one
CID 116880786
2-amino-2-[5-(4-bromothiophen-2-yl)-1H-imidazol-2-yl]ethanol
CID 116881580
methyl 2-[5-(2,4,6-trimethylphenyl)-1H-imidazol-2-yl]acetate
CID 116880265
1-[5-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]-3-methylbutan-1-amine
CID 43651303

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol?
The IUPAC name of 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol (CID 116881587) is 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol.
What is the SMILES notation for 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol?
The canonical SMILES for 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol is COc1cc(C)cc(C)c1-c1cnc(C(N)CO)[nH]1.
What is the InChIKey of 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol?
The InChIKey is SIEZMSMNXKCCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-8-4-9(2)13(12(5-8)19-3)11-6-16-14(17-11)10(15)7-18/h4-6,10,18H,7,15H2,1-3H3,(H,16,17).
What are the key properties of 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol?
2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol has a molecular weight of 261.32 g/mol, XLogP of 1.69, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[5-(2-methoxy-4,6-dimethylphenyl)-1H-imidazol-2-yl]ethanol is sourced from PubChem (CID 116881587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).