N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide

C18H21NO3 — CID 14406216

IUPACN-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide
SMILESCCCN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C18H21NO3/c1-2-12-19(21)18(20)13-15-8-10-17(11-9-15)22-14-16-6-4-3-5-7-16/h3-11,21H,2,12-14H2,1H3
InChIKeyUVQVCBMBHFKYJA-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.44
Rot. Bonds7

About N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide

N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide (PubChem CID 14406216) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide
PubChem CID14406216
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide
SMILESCCCN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C18H21NO3/c1-2-12-19(21)18(20)13-15-8-10-17(11-9-15)22-14-16-6-4-3-5-7-16/h3-11,21H,2,12-14H2,1H3
InChIKeyUVQVCBMBHFKYJA-UHFFFAOYSA-N
XLogP3.44
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.44
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'}

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Related Compounds

Bufexamac
CID 2466
A-63162
CID 121876
Acetohydroxamic acid, (p-propoxy)phenyl-
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2-(4-Butoxy-phenyl)-N-hydroxy-N-methyl-acetamide
CID 44386193
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-(4-benzyloxybenzyl)acetohydroxamic acid
CID 129265
6-[{(2s)-2-Amino-3-[4-(Benzyloxy)phenyl]propyl}(Hydroxy)amino]-6-Oxohexanoic Acid)
CID 23644581
(R)-N4-hydroxy-N1-((S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl)-2-(5-phenoxypentyl)succinamide
CID 10343996
N-methyl-2-oxo-8-(4-phenylphenoxy)octanamide
CID 44341043
N-(2-(1-Cyclohexen-1-yl)ethyl)-4-methoxybenzeneacetamide
CID 703658
2-(4-Benzyloxy-phenyl)-N-hydroxy-acetamide
CID 14545018

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide?
The IUPAC name of N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide (CID 14406216) is N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide.
What is the SMILES notation for N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide?
The canonical SMILES for N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide is CCCN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide?
The InChIKey is UVQVCBMBHFKYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-2-12-19(21)18(20)13-15-8-10-17(11-9-15)22-14-16-6-4-3-5-7-16/h3-11,21H,2,12-14H2,1H3.
What are the key properties of N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide?
N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide has a molecular weight of 299.37 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-phenylmethoxyphenyl)-N-propylacetamide is sourced from PubChem (CID 14406216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).