1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol

C15H23NO3 — CID 103339602

IUPAC1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol
SMILESC=CCN(CCOC)c1cccc(OC)c1C(C)O
InChIInChI=1S/C15H23NO3/c1-5-9-16(10-11-18-3)13-7-6-8-14(19-4)15(13)12(2)17/h5-8,12,17H,1,9-11H2,2-4H3
InChIKeyQCZJDOQVOBIJHT-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.39
Rot. Bonds8

About 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol

1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol (PubChem CID 103339602) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol.

Molecular Properties

Compound Name1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol
PubChem CID103339602
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol
SMILESC=CCN(CCOC)c1cccc(OC)c1C(C)O
InChIInChI=1S/C15H23NO3/c1-5-9-16(10-11-18-3)13-7-6-8-14(19-4)15(13)12(2)17/h5-8,12,17H,1,9-11H2,2-4H3
InChIKeyQCZJDOQVOBIJHT-UHFFFAOYSA-N
XLogP2.39
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(ethylamino)ethyl]-3-methoxy-N-(2-methoxyethyl)-N-prop-2-enylaniline
CID 103339209
2-[(1S)-1-aminoethyl]-3-methoxy-N,N-bis(prop-2-enyl)aniline
CID 113388926
2-[2-[(1R)-1-aminoethyl]-3-methoxy-N-(2-methoxyethyl)anilino]ethanol
CID 104861658
(1R)-1-[3-fluoro-4-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol
CID 103339609
1-[5-bromo-2-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol
CID 103339600
[2-chloro-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]methanol
CID 103339584
1-[2-[bis(prop-2-enyl)amino]-6-methoxyphenyl]ethanone
CID 113388829
2-[2-methoxyethyl(prop-2-enyl)amino]benzonitrile
CID 103339020
4-fluoro-N-(2-methoxyethyl)-2-[1-(methylamino)ethyl]-N-prop-2-enylaniline
CID 103339223
(1S)-1-[2-[cyclobutyl(methyl)amino]-6-methoxyphenyl]ethanol
CID 104873566
[2-[bis(2-methoxyethyl)amino]phenyl]-(4-methoxyphenyl)methanol
CID 102327787
1-(2,6-dimethoxyphenyl)prop-2-en-1-ol
CID 115814673

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol?
The IUPAC name of 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol (CID 103339602) is 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol.
What is the SMILES notation for 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol?
The canonical SMILES for 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol is C=CCN(CCOC)c1cccc(OC)c1C(C)O.
What is the InChIKey of 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol?
The InChIKey is QCZJDOQVOBIJHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-5-9-16(10-11-18-3)13-7-6-8-14(19-4)15(13)12(2)17/h5-8,12,17H,1,9-11H2,2-4H3.
What are the key properties of 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol?
1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol has a molecular weight of 265.35 g/mol, XLogP of 2.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxy-6-[2-methoxyethyl(prop-2-enyl)amino]phenyl]ethanol is sourced from PubChem (CID 103339602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).