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

C15H16FNO — CID 61412891

IUPAC[2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol
SMILESCN(Cc1ccccc1F)c1ccccc1CO
InChIInChI=1S/C15H16FNO/c1-17(10-12-6-2-4-8-14(12)16)15-9-5-3-7-13(15)11-18/h2-9,18H,10-11H2,1H3
InChIKeyYJQRCTSMLHNUEC-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.95
Rot. Bonds4

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

[2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol (PubChem CID 61412891) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol.

Molecular Properties

Compound Name[2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol
PubChem CID61412891
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name[2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol
SMILESCN(Cc1ccccc1F)c1ccccc1CO
InChIInChI=1S/C15H16FNO/c1-17(10-12-6-2-4-8-14(12)16)15-9-5-3-7-13(15)11-18/h2-9,18H,10-11H2,1H3
InChIKeyYJQRCTSMLHNUEC-UHFFFAOYSA-N
XLogP2.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol?
The IUPAC name of [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol (CID 61412891) is [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol.
What is the SMILES notation for [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol?
The canonical SMILES for [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol is CN(Cc1ccccc1F)c1ccccc1CO.
What is the InChIKey of [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol?
The InChIKey is YJQRCTSMLHNUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-17(10-12-6-2-4-8-14(12)16)15-9-5-3-7-13(15)11-18/h2-9,18H,10-11H2,1H3.
What are the key properties of [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol?
[2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol has a molecular weight of 245.30 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-fluorophenyl)methyl-methylamino]phenyl]methanol is sourced from PubChem (CID 61412891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).