N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide

C14H20FNO2 — CID 79200476

IUPACN-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide
SMILESCC(O)CCC(=O)N(C)C(C)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c1-10(17)8-9-14(18)16(3)11(2)12-6-4-5-7-13(12)15/h4-7,10-11,17H,8-9H2,1-3H3
InChIKeyIDUAWSFUZXFOLK-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.51
Rot. Bonds5

About N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide

N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide (PubChem CID 79200476) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide
PubChem CID79200476
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC NameN-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide
SMILESCC(O)CCC(=O)N(C)C(C)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c1-10(17)8-9-14(18)16(3)11(2)12-6-4-5-7-13(12)15/h4-7,10-11,17H,8-9H2,1-3H3
InChIKeyIDUAWSFUZXFOLK-UHFFFAOYSA-N
XLogP2.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4S)-4-amino-N-[(1R)-1-(2-fluorophenyl)ethyl]-N-methyl-4-phenylbutanamide
CID 99804367
N-[1-(2-fluorophenyl)ethyl]-N-methyl-2-(methylamino)acetamide
CID 60939648
N-[1-(2-fluorophenyl)ethyl]-N-methyl-2-phenoxyacetamide
CID 86925373
N-[(1R)-1-(2-fluorophenyl)ethyl]-2-(2-methoxyphenyl)-N-methylacetamide
CID 94042605
2-amino-N-[2-[1-(2-fluorophenyl)ethyl-methylamino]-2-oxoethyl]acetamide
CID 54870514
N-[3-[1-(2-fluorophenyl)ethyl-methylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 46590732
2-(1-aminocyclopentyl)-N-[1-(2-fluorophenyl)ethyl]-N-methylacetamide
CID 64685885
N-ethyl-N-(2-fluorophenyl)-4-hydroxypentanamide
CID 79192047
N-[1-(2-fluorophenyl)ethyl]-N-methylbut-2-enamide
CID 112725705
2-amino-N-[1-(2-fluorophenyl)ethyl]-N,4-dimethylpentanamide
CID 54870454
4-[[1-(2-fluorophenyl)ethyl-methylcarbamoyl]-methylamino]butanoic acid
CID 62986010
2-[1-(2-fluorophenyl)ethyl-methylamino]acetic acid
CID 62979540

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide?
The IUPAC name of N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide (CID 79200476) is N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide?
The canonical SMILES for N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide is CC(O)CCC(=O)N(C)C(C)c1ccccc1F.
What is the InChIKey of N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide?
The InChIKey is IDUAWSFUZXFOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-10(17)8-9-14(18)16(3)11(2)12-6-4-5-7-13(12)15/h4-7,10-11,17H,8-9H2,1-3H3.
What are the key properties of N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide?
N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide has a molecular weight of 253.32 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)ethyl]-4-hydroxy-N-methylpentanamide is sourced from PubChem (CID 79200476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).