[2-[(4-fluoroanilino)methyl]phenyl]methanol

C14H14FNO — CID 686996

IUPAC[2-[(4-fluoroanilino)methyl]phenyl]methanol
SMILESOCc1ccccc1CNc1ccc(F)cc1
InChIInChI=1S/C14H14FNO/c15-13-5-7-14(8-6-13)16-9-11-3-1-2-4-12(11)10-17/h1-8,16-17H,9-10H2
InChIKeyOXUUYYCYGDOZCD-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.93
Rot. Bonds4

About [2-[(4-fluoroanilino)methyl]phenyl]methanol

[2-[(4-fluoroanilino)methyl]phenyl]methanol (PubChem CID 686996) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is [2-[(4-fluoroanilino)methyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[(4-fluoroanilino)methyl]phenyl]methanol
PubChem CID686996
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name[2-[(4-fluoroanilino)methyl]phenyl]methanol
SMILESOCc1ccccc1CNc1ccc(F)cc1
InChIInChI=1S/C14H14FNO/c15-13-5-7-14(8-6-13)16-9-11-3-1-2-4-12(11)10-17/h1-8,16-17H,9-10H2
InChIKeyOXUUYYCYGDOZCD-UHFFFAOYSA-N
XLogP2.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[(4-fluoroanilino)methyl]phenyl]methanol?
The IUPAC name of [2-[(4-fluoroanilino)methyl]phenyl]methanol (CID 686996) is [2-[(4-fluoroanilino)methyl]phenyl]methanol.
What is the SMILES notation for [2-[(4-fluoroanilino)methyl]phenyl]methanol?
The canonical SMILES for [2-[(4-fluoroanilino)methyl]phenyl]methanol is OCc1ccccc1CNc1ccc(F)cc1.
What is the InChIKey of [2-[(4-fluoroanilino)methyl]phenyl]methanol?
The InChIKey is OXUUYYCYGDOZCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c15-13-5-7-14(8-6-13)16-9-11-3-1-2-4-12(11)10-17/h1-8,16-17H,9-10H2.
What are the key properties of [2-[(4-fluoroanilino)methyl]phenyl]methanol?
[2-[(4-fluoroanilino)methyl]phenyl]methanol has a molecular weight of 231.27 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-fluoroanilino)methyl]phenyl]methanol is sourced from PubChem (CID 686996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).