(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol

C16H19NO3 — CID 107469490

IUPAC(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2cccc(OC)c2N)c(C)c1
InChIInChI=1S/C16H19NO3/c1-10-9-11(19-2)7-8-12(10)16(18)13-5-4-6-14(20-3)15(13)17/h4-9,16,18H,17H2,1-3H3
InChIKeyCRFYMZFXRDCFSN-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.68
Rot. Bonds4

About (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol

(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol (PubChem CID 107469490) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol.

Molecular Properties

Compound Name(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol
PubChem CID107469490
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2cccc(OC)c2N)c(C)c1
InChIInChI=1S/C16H19NO3/c1-10-9-11(19-2)7-8-12(10)16(18)13-5-4-6-14(20-3)15(13)17/h4-9,16,18H,17H2,1-3H3
InChIKeyCRFYMZFXRDCFSN-UHFFFAOYSA-N
XLogP2.68
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.68
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

(2-amino-3-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 107469497
(2-amino-3-methoxyphenyl)-(3,4-dimethylphenyl)methanol
CID 107469517
(2-fluoro-6-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol
CID 65433478
(4-methoxy-2-methylphenyl)-phenylmethanol
CID 61101114
(R)-(3-amino-2-methylphenyl)-(2,4-dimethoxyphenyl)methanol
CID 100803991
(5-bromo-2-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol
CID 65313436
(2-amino-3-methoxyphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 107469597
(2-amino-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methanol
CID 107469586
(2,5-dimethylphenyl)-(4-methoxy-2-methylphenyl)methanol
CID 61101284
1-[chloro-(2,6-dimethoxyphenyl)methyl]-4-methoxy-2-methylbenzene
CID 61084322
(R)-(2-amino-3-methoxyphenyl)-(2,6-difluorophenyl)methanol
CID 124565399
(3-fluorophenyl)-(4-methoxy-2-methylphenyl)methanol
CID 61101111

Frequently Asked Questions

What is the IUPAC name of (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol?
The IUPAC name of (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol (CID 107469490) is (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol.
What is the SMILES notation for (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol?
The canonical SMILES for (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol is COc1ccc(C(O)c2cccc(OC)c2N)c(C)c1.
What is the InChIKey of (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol?
The InChIKey is CRFYMZFXRDCFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-10-9-11(19-2)7-8-12(10)16(18)13-5-4-6-14(20-3)15(13)17/h4-9,16,18H,17H2,1-3H3.
What are the key properties of (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol?
(2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol has a molecular weight of 273.33 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methanol is sourced from PubChem (CID 107469490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).