3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol

C16H19NO2 — CID 155241644

IUPAC3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol
SMILESCN(C)Cc1ccc(COc2cccc(O)c2)cc1
InChIInChI=1S/C16H19NO2/c1-17(2)11-13-6-8-14(9-7-13)12-19-16-5-3-4-15(18)10-16/h3-10,18H,11-12H2,1-2H3
InChIKeyDCZATIGTOZLOBH-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.03
Rot. Bonds5

About 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol

3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol (PubChem CID 155241644) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol.

Molecular Properties

Compound Name3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol
PubChem CID155241644
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol
SMILESCN(C)Cc1ccc(COc2cccc(O)c2)cc1
InChIInChI=1S/C16H19NO2/c1-17(2)11-13-6-8-14(9-7-13)12-19-16-5-3-4-15(18)10-16/h3-10,18H,11-12H2,1-2H3
InChIKeyDCZATIGTOZLOBH-UHFFFAOYSA-N
XLogP3.03
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-methylphenyl)methoxy]phenol
CID 39243397
3-[[4-[[3-(dimethylcarbamoyl)phenoxy]methyl]phenyl]methoxy]-N,N-dimethylbenzamide
CID 167758770
4-[(dimethylamino)methyl]-N-[4-[5-[(3-hydroxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide
CID 138481187
3-ethoxyphenol;iodoethane
CID 162028202
3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-ylmethoxy)phenol
CID 59027955
6-[4-[(dimethylamino)methyl]phenyl]naphthalen-2-ol
CID 50959857
3-[(4-ethylphenoxy)methyl]phenol
CID 70330427
N,N-dimethyl-3-[3-[(4-methylphenyl)methoxy]phenyl]propan-1-amine
CID 170866457
1-[3-[[4-(dimethylamino)phenyl]methoxy]phenyl]ethanone
CID 39205554
3-[[4-amino-3-(trifluoromethyl)phenyl]methoxy]phenol
CID 117220304
3-[[3-amino-4-(trifluoromethyl)phenyl]methoxy]phenol
CID 117221806
3-[[4-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline
CID 62484357

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol?
The IUPAC name of 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol (CID 155241644) is 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol.
What is the SMILES notation for 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol?
The canonical SMILES for 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol is CN(C)Cc1ccc(COc2cccc(O)c2)cc1.
What is the InChIKey of 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol?
The InChIKey is DCZATIGTOZLOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-17(2)11-13-6-8-14(9-7-13)12-19-16-5-3-4-15(18)10-16/h3-10,18H,11-12H2,1-2H3.
What are the key properties of 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol?
3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol has a molecular weight of 257.33 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[(dimethylamino)methyl]phenyl]methoxy]phenol is sourced from PubChem (CID 155241644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).