[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol

C15H17NO3 — CID 107742663

IUPAC[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OCc1cccc(N)c1
InChIInChI=1S/C15H17NO3/c1-18-15-8-11(9-17)5-6-14(15)19-10-12-3-2-4-13(16)7-12/h2-8,17H,9-10,16H2,1H3
InChIKeyDMZVJEWLMLQRBX-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.35
Rot. Bonds5

About [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol

[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol (PubChem CID 107742663) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol
PubChem CID107742663
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OCc1cccc(N)c1
InChIInChI=1S/C15H17NO3/c1-18-15-8-11(9-17)5-6-14(15)19-10-12-3-2-4-13(16)7-12/h2-8,17H,9-10,16H2,1H3
InChIKeyDMZVJEWLMLQRBX-UHFFFAOYSA-N
XLogP2.35
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[4-[[4-(aminomethyl)phenyl]methoxy]-3-methoxyphenyl]methanol
CID 107742818
3-[[4-(hydroxymethyl)-2-methoxyphenoxy]methyl]benzenecarbothioamide
CID 107743137
[4-[(3-amino-4-chlorophenyl)methoxy]-3-methoxyphenyl]methanol
CID 107742775
[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methanol
CID 28562159
3-methoxy-4-phenylmethoxyaniline
CID 27226
4-[(3-bromophenyl)methoxy]-3-methoxyaniline
CID 55036826
[3-methoxy-4-[(3-methoxyphenyl)methoxy]phenyl]methanamine
CID 60879812
[3-methoxy-4-(2-phenylethoxy)phenyl]methanol
CID 28562144
[4-[(5-amino-1,3,4-thiadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol
CID 107744788
[4-[(6-hydrazinyl-2-pyridinyl)methoxy]-3-methoxyphenyl]methanol
CID 107744846
4-methoxy-3-[(3-methylphenyl)methoxy]aniline
CID 16792794
2-[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]ethanamine
CID 20987766

Frequently Asked Questions

What is the IUPAC name of [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol?
The IUPAC name of [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol (CID 107742663) is [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol.
What is the SMILES notation for [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol?
The canonical SMILES for [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol is COc1cc(CO)ccc1OCc1cccc(N)c1.
What is the InChIKey of [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol?
The InChIKey is DMZVJEWLMLQRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-15-8-11(9-17)5-6-14(15)19-10-12-3-2-4-13(16)7-12/h2-8,17H,9-10,16H2,1H3.
What are the key properties of [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol?
[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol has a molecular weight of 259.31 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol is sourced from PubChem (CID 107742663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).