N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide

C19H23NO3 — CID 14156768

IUPACN-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide
SMILESCC(C)C(=O)N(O)C(C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)19(21)20(22)15(3)17-9-11-18(12-10-17)23-13-16-7-5-4-6-8-16/h4-12,14-15,22H,13H2,1-3H3
InChIKeyTVONVJMSMXDELB-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.20
Rot. Bonds6

About N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide

N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide (PubChem CID 14156768) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound NameN-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide
PubChem CID14156768
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide
SMILESCC(C)C(=O)N(O)C(C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)19(21)20(22)15(3)17-9-11-18(12-10-17)23-13-16-7-5-4-6-8-16/h4-12,14-15,22H,13H2,1-3H3
InChIKeyTVONVJMSMXDELB-UHFFFAOYSA-N
XLogP4.20
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide 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

1-hydroxy-1-[1-(6-phenylmethoxynaphthalen-2-yl)ethyl]urea
CID 54481028
(2R)-2-(4-phenylmethoxyphenoxy)propanoic acid
CID 1490297
(2S)-2-(4-phenylmethoxyphenoxy)propanoic acid
CID 1490295
1-(4-phenylmethoxyphenyl)ethanethiol
CID 43124131
[3-hydroxy-1-(4-phenylmethoxyphenyl)propyl]-methylcarbamic acid
CID 148920800
propan-2-yl 2-(4-phenylmethoxyphenyl)acetate
CID 82550165
(3R)-3-hydroxy-2,2-dimethyl-3-(4-phenylmethoxyphenyl)propanoic acid
CID 96839766
1-[4-(4-phenylmethoxyphenoxy)phenoxy]propan-2-ylcarbamic acid
CID 67071566
N,4-dihydroxy-N-methyl-2-oxo-4-(4-phenylmethoxyphenyl)butanamide
CID 174676377
N,N-dimethyl-2-(4-phenylmethoxyphenyl)acetamide;ethane
CID 143396477
2-methyl-5-(4-phenylmethoxyphenyl)pentanoic acid
CID 175893431
3-(dimethylamino)-2-methyl-3-(4-phenylmethoxyphenyl)propan-1-ol
CID 83932925

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide?
The IUPAC name of N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide (CID 14156768) is N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide.
What is the SMILES notation for N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide?
The canonical SMILES for N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide is CC(C)C(=O)N(O)C(C)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide?
The InChIKey is TVONVJMSMXDELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14(2)19(21)20(22)15(3)17-9-11-18(12-10-17)23-13-16-7-5-4-6-8-16/h4-12,14-15,22H,13H2,1-3H3.
What are the key properties of N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide?
N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide has a molecular weight of 313.40 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-methyl-N-[1-(4-phenylmethoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 14156768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).