[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol

C15H16FNO — CID 110906091

IUPAC[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol
SMILESOCc1ccccc1CNCc1ccc(F)cc1
InChIInChI=1S/C15H16FNO/c16-15-7-5-12(6-8-15)9-17-10-13-3-1-2-4-14(13)11-18/h1-8,17-18H,9-11H2
InChIKeyYEJVMUXTCUBMAV-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.61
Rot. Bonds5

About [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol

[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol (PubChem CID 110906091) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol
PubChem CID110906091
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol
SMILESOCc1ccccc1CNCc1ccc(F)cc1
InChIInChI=1S/C15H16FNO/c16-15-7-5-12(6-8-15)9-17-10-13-3-1-2-4-14(13)11-18/h1-8,17-18H,9-11H2
InChIKeyYEJVMUXTCUBMAV-UHFFFAOYSA-N
XLogP2.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
CID 17289839
1-(4-fluorophenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 834369
2-[[(4-fluorophenyl)methylamino]methyl]benzoic acid;hydrochloride
CID 17158189
1-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]methanamine;hydrochloride
CID 17292771
N-[(2-cyclopropylphenyl)methyl]-1-(4-fluorophenyl)methanamine
CID 79889960
1-(4-fluorophenyl)-N-(isoquinolin-4-ylmethyl)methanamine
CID 115748158
N-[(4-fluorophenyl)methyl]ethanamine
CID 4716481
[2-[[[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]methylamino]methyl]phenyl]methanol
CID 47626637
1-(4-fluorophenyl)-N-[(2-methylquinolin-4-yl)methyl]methanamine
CID 78978650
[2-[[(3-chloro-4-methoxyphenyl)methylamino]methyl]phenyl]methanol
CID 111466497
1-(4-ethylphenyl)-N-[(2-ethylphenyl)methyl]methanamine
CID 64680912
3-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]propan-1-amine
CID 131938810

Frequently Asked Questions

What is the IUPAC name of [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol?
The IUPAC name of [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol (CID 110906091) is [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol.
What is the SMILES notation for [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol?
The canonical SMILES for [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol is OCc1ccccc1CNCc1ccc(F)cc1.
What is the InChIKey of [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol?
The InChIKey is YEJVMUXTCUBMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c16-15-7-5-12(6-8-15)9-17-10-13-3-1-2-4-14(13)11-18/h1-8,17-18H,9-11H2.
What are the key properties of [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol?
[2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol has a molecular weight of 245.30 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(4-fluorophenyl)methylamino]methyl]phenyl]methanol is sourced from PubChem (CID 110906091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).