4-(2-fluorophenyl)-2-phenylmethoxyaniline

C19H16FNO — CID 171921752

IUPAC4-(2-fluorophenyl)-2-phenylmethoxyaniline
SMILESNc1ccc(-c2ccccc2F)cc1OCc1ccccc1
InChIInChI=1S/C19H16FNO/c20-17-9-5-4-8-16(17)15-10-11-18(21)19(12-15)22-13-14-6-2-1-3-7-14/h1-12H,13,21H2
InChIKeyQSQPNACFICDJQW-UHFFFAOYSA-N
MW293.34 g/mol
LogP4.65
Rot. Bonds4

About 4-(2-fluorophenyl)-2-phenylmethoxyaniline

4-(2-fluorophenyl)-2-phenylmethoxyaniline (PubChem CID 171921752) has the molecular formula C19H16FNO and a molecular weight of 293.34 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-2-phenylmethoxyaniline.

Molecular Properties

Compound Name4-(2-fluorophenyl)-2-phenylmethoxyaniline
PubChem CID171921752
Molecular FormulaC19H16FNO
Molecular Weight293.34 g/mol
Exact Mass293.12
IUPAC Name4-(2-fluorophenyl)-2-phenylmethoxyaniline
SMILESNc1ccc(-c2ccccc2F)cc1OCc1ccccc1
InChIInChI=1S/C19H16FNO/c20-17-9-5-4-8-16(17)15-10-11-18(21)19(12-15)22-13-14-6-2-1-3-7-14/h1-12H,13,21H2
InChIKeyQSQPNACFICDJQW-UHFFFAOYSA-N
XLogP4.65
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-phenylmethoxy-4-[4-(trifluoromethoxy)phenyl]aniline
CID 171921767
4-iodo-2-phenylmethoxyaniline
CID 66756754
2-(3-chloro-4-phenylmethoxyphenyl)aniline
CID 145161607
3-fluoro-5-(2-phenylmethoxyphenyl)pyridin-2-amine
CID 175669945
2-fluoro-4-(2-phenylmethoxyphenyl)benzoic acid
CID 53228660
[5-(4-chloro-2-fluorophenyl)-2-phenylmethoxyphenyl]methanamine
CID 172650028
4-(2,5-difluorophenyl)-2-phenylmethoxybenzonitrile
CID 175686453
6-(2-phenylmethoxyphenyl)naphthalen-2-amine
CID 172868680
4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678935
ethanamine;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174428998
5-(4-amino-3-phenylmethoxyphenyl)-3H-1,3,4-oxadiazol-2-one
CID 167126250
4-(4-chloro-2-fluorophenyl)-2-phenylmethoxybenzonitrile
CID 175686449

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-2-phenylmethoxyaniline?
The IUPAC name of 4-(2-fluorophenyl)-2-phenylmethoxyaniline (CID 171921752) is 4-(2-fluorophenyl)-2-phenylmethoxyaniline.
What is the SMILES notation for 4-(2-fluorophenyl)-2-phenylmethoxyaniline?
The canonical SMILES for 4-(2-fluorophenyl)-2-phenylmethoxyaniline is Nc1ccc(-c2ccccc2F)cc1OCc1ccccc1.
What is the InChIKey of 4-(2-fluorophenyl)-2-phenylmethoxyaniline?
The InChIKey is QSQPNACFICDJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO/c20-17-9-5-4-8-16(17)15-10-11-18(21)19(12-15)22-13-14-6-2-1-3-7-14/h1-12H,13,21H2.
What are the key properties of 4-(2-fluorophenyl)-2-phenylmethoxyaniline?
4-(2-fluorophenyl)-2-phenylmethoxyaniline has a molecular weight of 293.34 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-2-phenylmethoxyaniline is sourced from PubChem (CID 171921752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).