20-amino-N-hydroxyicosanamide

C20H42N2O2 — CID 87686702

IUPAC20-amino-N-hydroxyicosanamide
SMILESNCCCCCCCCCCCCCCCCCCCC(=O)NO
InChIInChI=1S/C20H42N2O2/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20(23)22-24/h24H,1-19,21H2,(H,22,23)
InChIKeyUMOSPCRFTWFDES-UHFFFAOYSA-N
MW342.57 g/mol
LogP5.47
Rot. Bonds19

About 20-amino-N-hydroxyicosanamide

20-amino-N-hydroxyicosanamide (PubChem CID 87686702) has the molecular formula C20H42N2O2 and a molecular weight of 342.57 g/mol. Its IUPAC name is 20-amino-N-hydroxyicosanamide.

Molecular Properties

Compound Name20-amino-N-hydroxyicosanamide
PubChem CID87686702
Molecular FormulaC20H42N2O2
Molecular Weight342.57 g/mol
Exact Mass342.32
IUPAC Name20-amino-N-hydroxyicosanamide
SMILESNCCCCCCCCCCCCCCCCCCCC(=O)NO
InChIInChI=1S/C20H42N2O2/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20(23)22-24/h24H,1-19,21H2,(H,22,23)
InChIKeyUMOSPCRFTWFDES-UHFFFAOYSA-N
XLogP5.47
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.57
LogP ≤ 55.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

14-amino-N-hydroxytetradecanamide
CID 87686192
27-amino-N-hydroxyheptacosanamide
CID 87684790
ethane;N'-hydroxyoctanediamide
CID 144754010
20-(hydroxyamino)-20-oxoicosanoic acid
CID 87685101
13-(hydroxyamino)-13-oxotridecanoic acid
CID 21490419
26-(hydroxyamino)-26-oxohexacosanoic acid
CID 87686862
N,16-dihydroxyhexadecanamide
CID 87686064
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
14-chloro-N-hydroxytetradecanamide
CID 87682446
20-bromo-N-hydroxyicosanamide
CID 87683991
N-hydroxy-8-iodooctanamide
CID 87681195

Frequently Asked Questions

What is the IUPAC name of 20-amino-N-hydroxyicosanamide?
The IUPAC name of 20-amino-N-hydroxyicosanamide (CID 87686702) is 20-amino-N-hydroxyicosanamide.
What is the SMILES notation for 20-amino-N-hydroxyicosanamide?
The canonical SMILES for 20-amino-N-hydroxyicosanamide is NCCCCCCCCCCCCCCCCCCCC(=O)NO.
What is the InChIKey of 20-amino-N-hydroxyicosanamide?
The InChIKey is UMOSPCRFTWFDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42N2O2/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20(23)22-24/h24H,1-19,21H2,(H,22,23).
What are the key properties of 20-amino-N-hydroxyicosanamide?
20-amino-N-hydroxyicosanamide has a molecular weight of 342.57 g/mol, XLogP of 5.47, 19 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 20-amino-N-hydroxyicosanamide is sourced from PubChem (CID 87686702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).