N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide

C17H27NO4 — CID 123800302

IUPACN-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide
SMILESCCCCCCCCC(C(=O)NO)c1ccc(O)c(OC)c1
InChIInChI=1S/C17H27NO4/c1-3-4-5-6-7-8-9-14(17(20)18-21)13-10-11-15(19)16(12-13)22-2/h10-12,14,19,21H,3-9H2,1-2H3,(H,18,20)
InChIKeyJGPGJMFIKYZVER-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.74
Rot. Bonds10

About N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide

N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide (PubChem CID 123800302) has the molecular formula C17H27NO4 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide
PubChem CID123800302
Molecular FormulaC17H27NO4
Molecular Weight309.41 g/mol
Exact Mass309.19
IUPAC NameN-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide
SMILESCCCCCCCCC(C(=O)NO)c1ccc(O)c(OC)c1
InChIInChI=1S/C17H27NO4/c1-3-4-5-6-7-8-9-14(17(20)18-21)13-10-11-15(19)16(12-13)22-2/h10-12,14,19,21H,3-9H2,1-2H3,(H,18,20)
InChIKeyJGPGJMFIKYZVER-UHFFFAOYSA-N
XLogP3.74
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-hydroxy-3-methoxyphenyl)-N-phenylmethoxynonanamide
CID 123770580
2-(4-hydroxy-3-methoxyphenyl)icos-11-enamide
CID 57346587
4-(1-hydroxyheptyl)-2-methoxyphenol
CID 14035097
2-(4-hydroxy-3-methoxyphenyl)-N-[(E)-nonadec-9-en-2-yl]propanamide
CID 70402625
4-hexan-2-yl-2-methoxyphenol
CID 10285881
2-[(4-hydroxy-3-methoxyphenyl)methyl]decanamide
CID 68625712
4-[(1R)-1-aminopentyl]-2-methoxyphenol;hydrochloride
CID 171203083
[3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)dodecan-5-yl]oxidanium
CID 143193328
1-(4-hydroxy-3-methoxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylamino]decan-2-one
CID 175348334
1,2-bis(4-hydroxy-3-methoxyphenyl)butan-1-one
CID 162941342
(3R,7R)-1-(3,4-dihydroxyphenyl)-3-hydroxy-7-(4-hydroxy-3-methoxyphenyl)dodecan-5-one
CID 162837226
5-(1-hydroxydodecyl)-2-methoxyphenol
CID 139789005

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide?
The IUPAC name of N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide (CID 123800302) is N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide.
What is the SMILES notation for N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide?
The canonical SMILES for N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide is CCCCCCCCC(C(=O)NO)c1ccc(O)c(OC)c1.
What is the InChIKey of N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide?
The InChIKey is JGPGJMFIKYZVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO4/c1-3-4-5-6-7-8-9-14(17(20)18-21)13-10-11-15(19)16(12-13)22-2/h10-12,14,19,21H,3-9H2,1-2H3,(H,18,20).
What are the key properties of N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide?
N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide has a molecular weight of 309.41 g/mol, XLogP of 3.74, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-hydroxy-3-methoxyphenyl)decanamide is sourced from PubChem (CID 123800302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).