4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol

C20H25NO2 — CID 18988705

IUPAC4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol
SMILESCC/C=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1
InChIInChI=1S/C20H25NO2/c1-4-5-20(16-6-10-18(22)11-7-16)17-8-12-19(13-9-17)23-15-14-21(2)3/h5-13,22H,4,14-15H2,1-3H3/b20-5-
InChIKeyZIYCHFNKTZJGJJ-SDPNRITHSA-N
MW311.43 g/mol
LogP4.17
Rot. Bonds7

About 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol

4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol (PubChem CID 18988705) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol.

Molecular Properties

Compound Name4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol
PubChem CID18988705
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol
SMILESCC/C=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1
InChIInChI=1S/C20H25NO2/c1-4-5-20(16-6-10-18(22)11-7-16)17-8-12-19(13-9-17)23-15-14-21(2)3/h5-13,22H,4,14-15H2,1-3H3/b20-5-
InChIKeyZIYCHFNKTZJGJJ-SDPNRITHSA-N
XLogP4.17
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[4-[(Z)-1-(4-phenylmethoxyphenyl)but-1-enyl]phenoxy]ethanamine
CID 67771766
(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol
CID 57407502
4-[(Z)-2-[4-[2-(dimethylamino)ethoxy]phenyl]pent-2-en-3-yl]phenol
CID 164901766
[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone;(4-hydroxyphenyl)-phenylmethanone
CID 159812426
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-(4-methoxyphenyl)but-1-enyl]phenol
CID 15819111
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-(4-methylphenyl)but-1-enyl]phenol
CID 70452979
4-[(E)-1-[4-[2-(diethylamino)ethoxy]phenyl]oct-1-enyl]phenol
CID 10620728
4-[cyclohexylidene-[4-[2-(dimethylamino)ethoxy]phenyl]methyl]phenol
CID 86155740
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-(4-propan-2-ylphenyl)but-1-enyl]phenol;hydrochloride
CID 67944530
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-(4-phenylmethoxyphenyl)but-1-enyl]phenol
CID 70684715
4-[[4-[2-(dimethylamino)ethoxy]phenyl]-(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol;hydrochloride
CID 69164111
N-[4-[2-(dimethylamino)ethoxy]phenyl]-2,3-bis(4-hydroxyphenyl)pent-2-enamide
CID 68732320

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol?
The IUPAC name of 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol (CID 18988705) is 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol.
What is the SMILES notation for 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol?
The canonical SMILES for 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol is CC/C=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1.
What is the InChIKey of 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol?
The InChIKey is ZIYCHFNKTZJGJJ-SDPNRITHSA-N. The full InChI is InChI=1S/C20H25NO2/c1-4-5-20(16-6-10-18(22)11-7-16)17-8-12-19(13-9-17)23-15-14-21(2)3/h5-13,22H,4,14-15H2,1-3H3/b20-5-.
What are the key properties of 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol?
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol has a molecular weight of 311.43 g/mol, XLogP of 4.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol is sourced from PubChem (CID 18988705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).