4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol

C18H23NO2 — CID 138383034

IUPAC4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol
SMILESCCc1cc(O)ccc1-c1ccccc1OCCN(C)C
InChIInChI=1S/C18H23NO2/c1-4-14-13-15(20)9-10-16(14)17-7-5-6-8-18(17)21-12-11-19(2)3/h5-10,13,20H,4,11-12H2,1-3H3
InChIKeyYVRALZPVCPHGMV-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.56
Rot. Bonds6

About 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol

4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol (PubChem CID 138383034) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol.

Molecular Properties

Compound Name4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol
PubChem CID138383034
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol
SMILESCCc1cc(O)ccc1-c1ccccc1OCCN(C)C
InChIInChI=1S/C18H23NO2/c1-4-14-13-15(20)9-10-16(14)17-7-5-6-8-18(17)21-12-11-19(2)3/h5-10,13,20H,4,11-12H2,1-3H3
InChIKeyYVRALZPVCPHGMV-UHFFFAOYSA-N
XLogP3.56
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-4-[2-(2-imidazol-1-ylethoxy)phenyl]phenol
CID 138378576
4-[5-[2-[2-(dimethylamino)ethoxy]phenyl]-1,2,4-oxadiazol-3-yl]phenol
CID 135704072
4-(2,3-dimethylphenyl)-3-ethylphenol
CID 67060116
N,N-dimethyl-3-(2-phenylphenoxy)propan-1-amine
CID 2184471
1-[2-[2-(dimethylamino)ethoxy]-6-hydroxyphenyl]propan-1-one
CID 71450597
N,N-dimethyl-4-(2-phenylphenoxy)butan-1-amine
CID 2182223
4-[2-[5-[2-[2-(dimethylamino)ethoxy]phenyl]-1,2,4-oxadiazol-3-yl]ethenyl]phenol
CID 152781552
3-[2-[2-(dimethylamino)ethoxy]phenyl]propanoyl chloride
CID 39260422
N,N-dimethyl-2-[2-(methylaminomethyl)phenoxy]ethanamine
CID 18525858
2-[2-(dimethylamino)ethoxy]-N-methylbenzamide
CID 69175199
3-ethyl-2-(2-ethyl-4-hydroxyphenyl)phenol
CID 101302728
5-[2-(dimethylamino)ethoxy]benzo[b][1]benzothiepin-3-ol
CID 59065639

Frequently Asked Questions

What is the IUPAC name of 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol?
The IUPAC name of 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol (CID 138383034) is 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol.
What is the SMILES notation for 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol?
The canonical SMILES for 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol is CCc1cc(O)ccc1-c1ccccc1OCCN(C)C.
What is the InChIKey of 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol?
The InChIKey is YVRALZPVCPHGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-4-14-13-15(20)9-10-16(14)17-7-5-6-8-18(17)21-12-11-19(2)3/h5-10,13,20H,4,11-12H2,1-3H3.
What are the key properties of 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol?
4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol has a molecular weight of 285.39 g/mol, XLogP of 3.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[2-(dimethylamino)ethoxy]phenyl]-3-ethylphenol is sourced from PubChem (CID 138383034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).