anilino-[3-(4-methylphenoxy)phenyl]methanol

C20H19NO2 — CID 142160349

IUPACanilino-[3-(4-methylphenoxy)phenyl]methanol
SMILESCc1ccc(Oc2cccc(C(O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C20H19NO2/c1-15-10-12-18(13-11-15)23-19-9-5-6-16(14-19)20(22)21-17-7-3-2-4-8-17/h2-14,20-22H,1H3
InChIKeyFNQFLDSTBPAZFG-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.89
Rot. Bonds5

About anilino-[3-(4-methylphenoxy)phenyl]methanol

anilino-[3-(4-methylphenoxy)phenyl]methanol (PubChem CID 142160349) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is anilino-[3-(4-methylphenoxy)phenyl]methanol.

Molecular Properties

Compound Nameanilino-[3-(4-methylphenoxy)phenyl]methanol
PubChem CID142160349
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Nameanilino-[3-(4-methylphenoxy)phenyl]methanol
SMILESCc1ccc(Oc2cccc(C(O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C20H19NO2/c1-15-10-12-18(13-11-15)23-19-9-5-6-16(14-19)20(22)21-17-7-3-2-4-8-17/h2-14,20-22H,1H3
InChIKeyFNQFLDSTBPAZFG-UHFFFAOYSA-N
XLogP4.89
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(3-phenoxyphenyl)ethanol
CID 12882419
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
N-methoxy-3-phenoxyaniline
CID 90688975
4-methyl-N-(3-phenoxyphenyl)benzenesulfonamide
CID 169370090
2-methyl-1-[3-(4-propan-2-ylphenoxy)anilino]propan-1-ol
CID 129035187
(2S,3R,4S)-4-(3-phenoxyphenyl)pentane-2,3-diol
CID 135050581
(1S,2R)-1-amino-1-(3-phenoxyphenyl)propan-2-ol
CID 171266953
1-chloro-3-(3-phenoxyanilino)propan-2-ol
CID 168636658
2-(4-methoxyanilino)-1-(4-methylphenyl)-2-phenylethanol
CID 101146915
3-methyl-1-(3-phenoxyphenyl)butan-1-ol
CID 63893717
3-(4-methylphenyl)-2-(3-phenoxyphenyl)propan-1-amine
CID 83973436
1-(4-methylphenyl)-3-(3-phenoxyphenyl)propan-1-ol
CID 82185660

Frequently Asked Questions

What is the IUPAC name of anilino-[3-(4-methylphenoxy)phenyl]methanol?
The IUPAC name of anilino-[3-(4-methylphenoxy)phenyl]methanol (CID 142160349) is anilino-[3-(4-methylphenoxy)phenyl]methanol.
What is the SMILES notation for anilino-[3-(4-methylphenoxy)phenyl]methanol?
The canonical SMILES for anilino-[3-(4-methylphenoxy)phenyl]methanol is Cc1ccc(Oc2cccc(C(O)Nc3ccccc3)c2)cc1.
What is the InChIKey of anilino-[3-(4-methylphenoxy)phenyl]methanol?
The InChIKey is FNQFLDSTBPAZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-15-10-12-18(13-11-15)23-19-9-5-6-16(14-19)20(22)21-17-7-3-2-4-8-17/h2-14,20-22H,1H3.
What are the key properties of anilino-[3-(4-methylphenoxy)phenyl]methanol?
anilino-[3-(4-methylphenoxy)phenyl]methanol has a molecular weight of 305.38 g/mol, XLogP of 4.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for anilino-[3-(4-methylphenoxy)phenyl]methanol is sourced from PubChem (CID 142160349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).