N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide

C19H24NO3P — CID 118341051

IUPACN-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide
SMILESCP(=O)(CCCCCC(=O)Nc1ccccc1O)c1ccccc1
InChIInChI=1S/C19H24NO3P/c1-24(23,16-10-4-2-5-11-16)15-9-3-6-14-19(22)20-17-12-7-8-13-18(17)21/h2,4-5,7-8,10-13,21H,3,6,9,14-15H2,1H3,(H,20,22)
InChIKeyQIWMHDZQVOFMKA-UHFFFAOYSA-N
MW345.38 g/mol
LogP4.21
Rot. Bonds8

About N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide

N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide (PubChem CID 118341051) has the molecular formula C19H24NO3P and a molecular weight of 345.38 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide
PubChem CID118341051
Molecular FormulaC19H24NO3P
Molecular Weight345.38 g/mol
Exact Mass345.15
IUPAC NameN-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide
SMILESCP(=O)(CCCCCC(=O)Nc1ccccc1O)c1ccccc1
InChIInChI=1S/C19H24NO3P/c1-24(23,16-10-4-2-5-11-16)15-9-3-6-14-19(22)20-17-12-7-8-13-18(17)21/h2,4-5,7-8,10-13,21H,3,6,9,14-15H2,1H3,(H,20,22)
InChIKeyQIWMHDZQVOFMKA-UHFFFAOYSA-N
XLogP4.21
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

N'-(2-hydroxyphenyl)-N-(4-methylphenyl)heptanediamide
CID 45254124
N'-[(E)-benzylideneamino]-N-(2-hydroxyphenyl)heptanediamide
CID 23642529
(Z)-N-(2-hydroxyphenyl)octadec-9-enamide
CID 52916764
6-(benzenesulfonyl)-N-(2-hydroxyphenyl)hexanamide
CID 135365962
N-(2-hydroxyphenyl)-N'-[(E)-pent-4-enylideneamino]octanediamide
CID 44507497
N-(2-hydroxyphenyl)-N'-[(E)-(2-methylphenyl)methylideneamino]octanediamide
CID 44507510
ethane;N-(2-hydroxyphenyl)butanamide
CID 142538893
N-(2-hydroxyphenyl)-N'-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]octanediamide
CID 44507893
N-(2-hydroxy-5-phenylphenyl)octanamide
CID 155558351
3-(2-hydroxyanilino)-3-oxopropanoic acid
CID 69016240
4-(2-hydroxyanilino)-4-oxobutanoate
CID 3615801
3-acetamido-N-(2-hydroxyphenyl)propanamide
CID 47110153

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide?
The IUPAC name of N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide (CID 118341051) is N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide?
The canonical SMILES for N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide is CP(=O)(CCCCCC(=O)Nc1ccccc1O)c1ccccc1.
What is the InChIKey of N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide?
The InChIKey is QIWMHDZQVOFMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24NO3P/c1-24(23,16-10-4-2-5-11-16)15-9-3-6-14-19(22)20-17-12-7-8-13-18(17)21/h2,4-5,7-8,10-13,21H,3,6,9,14-15H2,1H3,(H,20,22).
What are the key properties of N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide?
N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide has a molecular weight of 345.38 g/mol, XLogP of 4.21, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-6-[methyl(phenyl)phosphoryl]hexanamide is sourced from PubChem (CID 118341051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).