N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide

C11H14FNO2 — CID 2811149

IUPACN-[(4-fluorophenyl)methyl]-4-hydroxybutanamide
SMILESO=C(CCCO)NCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c12-10-5-3-9(4-6-10)8-13-11(15)2-1-7-14/h3-6,14H,1-2,7-8H2,(H,13,15)
InChIKeySBSPYHWRGOXXLG-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.21
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide

N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide (PubChem CID 2811149) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-4-hydroxybutanamide
PubChem CID2811149
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC NameN-[(4-fluorophenyl)methyl]-4-hydroxybutanamide
SMILESO=C(CCCO)NCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c12-10-5-3-9(4-6-10)8-13-11(15)2-1-7-14/h3-6,14H,1-2,7-8H2,(H,13,15)
InChIKeySBSPYHWRGOXXLG-UHFFFAOYSA-N
XLogP1.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide (CID 2811149) is N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide is O=C(CCCO)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide?
The InChIKey is SBSPYHWRGOXXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-10-5-3-9(4-6-10)8-13-11(15)2-1-7-14/h3-6,14H,1-2,7-8H2,(H,13,15).
What are the key properties of N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide?
N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide has a molecular weight of 211.24 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-4-hydroxybutanamide is sourced from PubChem (CID 2811149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).