2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol

C16H17NO — CID 174746341

IUPAC2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol
SMILESCN(C)c1cccc(/C=C/c2ccccc2)c1O
InChIInChI=1S/C16H17NO/c1-17(2)15-10-6-9-14(16(15)18)12-11-13-7-4-3-5-8-13/h3-12,18H,1-2H3/b12-11+
InChIKeyLCQAIBOASVULQF-VAWYXSNFSA-N
MW239.32 g/mol
LogP3.63
Rot. Bonds3

About 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol

2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol (PubChem CID 174746341) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol.

Molecular Properties

Compound Name2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol
PubChem CID174746341
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol
SMILESCN(C)c1cccc(/C=C/c2ccccc2)c1O
InChIInChI=1S/C16H17NO/c1-17(2)15-10-6-9-14(16(15)18)12-11-13-7-4-3-5-8-13/h3-12,18H,1-2H3/b12-11+
InChIKeyLCQAIBOASVULQF-VAWYXSNFSA-N
XLogP3.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol;methanesulfinate
CID 174746340
2-methyl-6-[(E)-2-phenylethenyl]phenol
CID 22713146
2-[2-(4-chlorophenyl)ethenyl]-N,N-dimethylaniline
CID 53425877
N,N-dimethylmethanamine;stilbene
CID 174368184
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
2-chloro-3-(2-phenylethenyl)phenol
CID 70555314
2-nitro-6-(2-phenylethenyl)phenol
CID 57159436
N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
CID 132506209
2-methyl-4,6-bis[(E)-2-phenylethenyl]phenol
CID 6071425
3-[[2,3-dihydroxy-4-[(E)-2-phenylethenyl]phenyl]diazenyl]-6-[(E)-2-phenylethenyl]benzene-1,2-diol
CID 137232949
2-(dimethylamino)-4-[2-[3-[2-[3-(dimethylamino)-4-hydroxyphenyl]ethenyl]phenyl]ethenyl]phenol
CID 91343377
1-[2,3-bis(dimethylamino)phenyl]-3-phenylprop-2-en-1-one
CID 175290559

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol?
The IUPAC name of 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol (CID 174746341) is 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol.
What is the SMILES notation for 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol?
The canonical SMILES for 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol is CN(C)c1cccc(/C=C/c2ccccc2)c1O.
What is the InChIKey of 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol?
The InChIKey is LCQAIBOASVULQF-VAWYXSNFSA-N. The full InChI is InChI=1S/C16H17NO/c1-17(2)15-10-6-9-14(16(15)18)12-11-13-7-4-3-5-8-13/h3-12,18H,1-2H3/b12-11+.
What are the key properties of 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol?
2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol has a molecular weight of 239.32 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol is sourced from PubChem (CID 174746341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).