N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide

C18H21FN2O2 — CID 141129542

IUPACN-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide
SMILESCCCC(O)(C(=O)NCc1cc(C)cnc1F)c1ccccc1
InChIInChI=1S/C18H21FN2O2/c1-3-9-18(23,15-7-5-4-6-8-15)17(22)21-12-14-10-13(2)11-20-16(14)19/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,21,22)
InChIKeyLUFYVHISJWFMFX-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.83
Rot. Bonds6

About N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide

N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide (PubChem CID 141129542) has the molecular formula C18H21FN2O2 and a molecular weight of 316.38 g/mol. Its IUPAC name is N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide.

Molecular Properties

Compound NameN-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide
PubChem CID141129542
Molecular FormulaC18H21FN2O2
Molecular Weight316.38 g/mol
Exact Mass316.16
IUPAC NameN-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide
SMILESCCCC(O)(C(=O)NCc1cc(C)cnc1F)c1ccccc1
InChIInChI=1S/C18H21FN2O2/c1-3-9-18(23,15-7-5-4-6-8-15)17(22)21-12-14-10-13(2)11-20-16(14)19/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,21,22)
InChIKeyLUFYVHISJWFMFX-UHFFFAOYSA-N
XLogP2.83
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide 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

N-[(2,5-dimethyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylbutanamide
CID 143155991
1-(5-fluoro-3-pyridinyl)-1-phenylbutan-1-ol
CID 54966036
1-(6-methyl-3-pyridinyl)-1-phenylbutan-1-ol
CID 63155797
2-[[(3,5-dimethylpyridine-2-carbonyl)amino]methyl]-2-phenylbutanoic acid
CID 138054880
N-ethyl-2-hydroxy-4-oxo-2-phenylpentanamide
CID 162412364
2-hydroxy-1-nitro-2-phenylpentan-1-one
CID 140977934
2-methyl-3-phenylhex-1-en-3-ol
CID 79189564
2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylpropanamide
CID 62487194
N-[(4-methylphenyl)methyl]-2-[(4-methylphenyl)methylamino]-2,2-diphenylacetamide
CID 5153157
(2R)-N-[(5-bromo-2-fluorophenyl)methyl]-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide
CID 58960075
2-amino-2-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]pentanamide
CID 62880973
N'-[2-(2-fluorophenyl)acetyl]-3-hydroxy-3-phenylbutanehydrazide
CID 110025321

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide?
The IUPAC name of N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide (CID 141129542) is N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide.
What is the SMILES notation for N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide?
The canonical SMILES for N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide is CCCC(O)(C(=O)NCc1cc(C)cnc1F)c1ccccc1.
What is the InChIKey of N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide?
The InChIKey is LUFYVHISJWFMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2/c1-3-9-18(23,15-7-5-4-6-8-15)17(22)21-12-14-10-13(2)11-20-16(14)19/h4-8,10-11,23H,3,9,12H2,1-2H3,(H,21,22).
What are the key properties of N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide?
N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide has a molecular weight of 316.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluoro-5-methyl-3-pyridinyl)methyl]-2-hydroxy-2-phenylpentanamide is sourced from PubChem (CID 141129542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).