(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol

C19H23NO2 — CID 57407502

IUPAC(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol
SMILESCN(C)CCOc1ccc(/C(=C\CO)c2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-20(2)13-15-22-18-10-8-17(9-11-18)19(12-14-21)16-6-4-3-5-7-16/h3-12,21H,13-15H2,1-2H3/b19-12-
InChIKeyCAJWGRWGCCMDHZ-UNOMPAQXSA-N
MW297.40 g/mol
LogP3.05
Rot. Bonds7

About (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol

(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol (PubChem CID 57407502) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol
PubChem CID57407502
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol
SMILESCN(C)CCOc1ccc(/C(=C\CO)c2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-20(2)13-15-22-18-10-8-17(9-11-18)19(12-14-21)16-6-4-3-5-7-16/h3-12,21H,13-15H2,1-2H3/b19-12-
InChIKeyCAJWGRWGCCMDHZ-UNOMPAQXSA-N
XLogP3.05
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.05
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
[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone;molybdenum
CID 159586330
4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]but-1-enyl]phenol
CID 18988705
[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone;(4-hydroxyphenyl)-phenylmethanone
CID 159812426
(E,2S)-4-[4-[2-(dimethylamino)ethoxy]phenyl]-3,4-diphenylbut-3-en-2-ol
CID 24834606
2-[4-[(E)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
CID 6536897
2-[4-[(Z)-4-bromo-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
CID 13424658
N,N-dimethyl-2-[4-[(Z)-1-(4-methylphenyl)-2-phenylbut-1-enyl]phenoxy]ethanamine
CID 3037296
2-[4-[(1Z,3E,4Z)-2-ethyl-3-ethylidene-1-phenylhexa-1,4-dienyl]phenoxy]-N,N-dimethylethanamine
CID 142962747
[4-[9-(dimethylamino)nonoxy]phenyl]-phenylmethanone
CID 19760990
2-[4-[2-cyclopentyl-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenylethenyl]phenoxy]-N,N-dimethylethanamine
CID 172640286
2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine formate
CID 131723672

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol?
The IUPAC name of (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol (CID 57407502) is (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol.
What is the SMILES notation for (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol?
The canonical SMILES for (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol is CN(C)CCOc1ccc(/C(=C\CO)c2ccccc2)cc1.
What is the InChIKey of (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol?
The InChIKey is CAJWGRWGCCMDHZ-UNOMPAQXSA-N. The full InChI is InChI=1S/C19H23NO2/c1-20(2)13-15-22-18-10-8-17(9-11-18)19(12-14-21)16-6-4-3-5-7-16/h3-12,21H,13-15H2,1-2H3/b19-12-.
What are the key properties of (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol?
(Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol has a molecular weight of 297.40 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-en-1-ol is sourced from PubChem (CID 57407502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).