N,16-dihydroxyhexadecanamide

C16H33NO3 — CID 87686064

IUPACN,16-dihydroxyhexadecanamide
SMILESO=C(CCCCCCCCCCCCCCCO)NO
InChIInChI=1S/C16H33NO3/c18-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)17-20/h18,20H,1-15H2,(H,17,19)
InChIKeyCEWQYCKVTVFFKV-UHFFFAOYSA-N
MW287.44 g/mol
LogP3.95
Rot. Bonds15

About N,16-dihydroxyhexadecanamide

N,16-dihydroxyhexadecanamide (PubChem CID 87686064) has the molecular formula C16H33NO3 and a molecular weight of 287.44 g/mol. Its IUPAC name is N,16-dihydroxyhexadecanamide.

Molecular Properties

Compound NameN,16-dihydroxyhexadecanamide
PubChem CID87686064
Molecular FormulaC16H33NO3
Molecular Weight287.44 g/mol
Exact Mass287.25
IUPAC NameN,16-dihydroxyhexadecanamide
SMILESO=C(CCCCCCCCCCCCCCCO)NO
InChIInChI=1S/C16H33NO3/c18-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)17-20/h18,20H,1-15H2,(H,17,19)
InChIKeyCEWQYCKVTVFFKV-UHFFFAOYSA-N
XLogP3.95
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.44
LogP ≤ 53.95
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

20-(hydroxyamino)-20-oxoicosanoic acid
CID 87685101
13-(hydroxyamino)-13-oxotridecanoic acid
CID 21490419
26-(hydroxyamino)-26-oxohexacosanoic acid
CID 87686862
20-amino-N-hydroxyicosanamide
CID 87686702
20-bromo-N-hydroxyicosanamide
CID 87683991
N-hydroxy-8-iodooctanamide
CID 87681195
14-amino-N-hydroxytetradecanamide
CID 87686192
12-hydroxydodecanehydrazide
CID 12718243
30-chloro-N-hydroxytriacontanamide
CID 87686920
N-hydroxy-31-sulfanylhentriacontanamide
CID 87684217
N-hydroxytridecanamide
CID 14122613
N-hydroxy-26-sulfanylhexacosanamide
CID 87681311

Frequently Asked Questions

What is the IUPAC name of N,16-dihydroxyhexadecanamide?
The IUPAC name of N,16-dihydroxyhexadecanamide (CID 87686064) is N,16-dihydroxyhexadecanamide.
What is the SMILES notation for N,16-dihydroxyhexadecanamide?
The canonical SMILES for N,16-dihydroxyhexadecanamide is O=C(CCCCCCCCCCCCCCCO)NO.
What is the InChIKey of N,16-dihydroxyhexadecanamide?
The InChIKey is CEWQYCKVTVFFKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO3/c18-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)17-20/h18,20H,1-15H2,(H,17,19).
What are the key properties of N,16-dihydroxyhexadecanamide?
N,16-dihydroxyhexadecanamide has a molecular weight of 287.44 g/mol, XLogP of 3.95, 15 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,16-dihydroxyhexadecanamide is sourced from PubChem (CID 87686064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).