4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol

C11H14N2O3 — CID 136822407

IUPAC4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol
SMILESCOc1cc(C2=NCCN2)cc(OC)c1O
InChIInChI=1S/C11H14N2O3/c1-15-8-5-7(11-12-3-4-13-11)6-9(16-2)10(8)14/h5-6,14H,3-4H2,1-2H3,(H,12,13)
InChIKeyCSRVENYYYXFNCD-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.76
Rot. Bonds3

About 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol

4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol (PubChem CID 136822407) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol
PubChem CID136822407
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol
SMILESCOc1cc(C2=NCCN2)cc(OC)c1O
InChIInChI=1S/C11H14N2O3/c1-15-8-5-7(11-12-3-4-13-11)6-9(16-2)10(8)14/h5-6,14H,3-4H2,1-2H3,(H,12,13)
InChIKeyCSRVENYYYXFNCD-UHFFFAOYSA-N
XLogP0.76
TPSA63.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-imidazole
CID 15327588
(4S)-4-(4,5-dihydro-1H-imidazol-2-yl)-3,4-dihydro-2H-chromene-7,8-diol
CID 44280971
2-(3,5-dimethoxyphenyl)-4,5-dihydro-1H-imidazole hydrochloride
CID 2946578
4,5-Dihydro-2-((3,4,5-trimethoxyphenyl)methyl)-1H-imidazole
CID 7552
2,6-Dimethoxy-4-[(octylamino)methyl]phenol;hydrochloride
CID 45259598
2,6-Dimethoxy-4-[(nonylamino)methyl]phenol;hydrochloride
CID 45263996
7,8-dimethyl-6-tetradecyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-6-ol bromide
CID 164623092
2-Imidazoline, 2-methyl-1-(3,4,5-trimethoxythiobenzoyl)-
CID 51155
Phenol, 2-methoxy-4-((2-oxazolin-2-yl)amino)methyl-
CID 3064069
2-(4,5-Dihydro-1H-imidazol-2-YL)-5-(octyloxy)phenol
CID 4052484
2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-imidazole
CID 24820329
(5S)-N-methoxy-N-methyl-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-imidazole-5-carboxamide
CID 44586505

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol (CID 136822407) is 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol.
What is the SMILES notation for 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The canonical SMILES for 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol is COc1cc(C2=NCCN2)cc(OC)c1O.
What is the InChIKey of 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The InChIKey is CSRVENYYYXFNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-15-8-5-7(11-12-3-4-13-11)6-9(16-2)10(8)14/h5-6,14H,3-4H2,1-2H3,(H,12,13).
What are the key properties of 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol has a molecular weight of 222.24 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethoxyphenol is sourced from PubChem (CID 136822407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).