17-oxoheptadecanamide

C17H33NO2 — CID 54112129

IUPAC17-oxoheptadecanamide
SMILESNC(=O)CCCCCCCCCCCCCCCC=O
InChIInChI=1S/C17H33NO2/c18-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-19/h16H,1-15H2,(H2,18,20)
InChIKeyRKOUTNRDSFCMQU-UHFFFAOYSA-N
MW283.46 g/mol
LogP4.52
Rot. Bonds16

About 17-oxoheptadecanamide

17-oxoheptadecanamide (PubChem CID 54112129) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is 17-oxoheptadecanamide.

Molecular Properties

Compound Name17-oxoheptadecanamide
PubChem CID54112129
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC Name17-oxoheptadecanamide
SMILESNC(=O)CCCCCCCCCCCCCCCC=O
InChIInChI=1S/C17H33NO2/c18-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-19/h16H,1-15H2,(H2,18,20)
InChIKeyRKOUTNRDSFCMQU-UHFFFAOYSA-N
XLogP4.52
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

12-oxododecanamide
CID 54019408
6-oxohexanamide;2,2,2-trifluoroacetic acid
CID 175908161
hentetraconta-10,31-dienediamide
CID 175604494
dopentaconta-13,39-dienediamide
CID 154089546
(E)-hexadec-8-enediamide
CID 21140246
dodecanediamide;nonanediamide
CID 175017820
docosanediamide;hexacosanediamide
CID 129179979
pentadecanediamide
CID 87429217
nonatetracontanediamide
CID 162734608
icosa-8,12-dienediamide
CID 154110661
2-oxododecanedial
CID 175394430
nonadec-18-enamide
CID 166991988

Frequently Asked Questions

What is the IUPAC name of 17-oxoheptadecanamide?
The IUPAC name of 17-oxoheptadecanamide (CID 54112129) is 17-oxoheptadecanamide.
What is the SMILES notation for 17-oxoheptadecanamide?
The canonical SMILES for 17-oxoheptadecanamide is NC(=O)CCCCCCCCCCCCCCCC=O.
What is the InChIKey of 17-oxoheptadecanamide?
The InChIKey is RKOUTNRDSFCMQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c18-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-19/h16H,1-15H2,(H2,18,20).
What are the key properties of 17-oxoheptadecanamide?
17-oxoheptadecanamide has a molecular weight of 283.46 g/mol, XLogP of 4.52, 16 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 17-oxoheptadecanamide is sourced from PubChem (CID 54112129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).