N-oxooctanamide

C8H15NO2 — CID 87234486

IUPACN-oxooctanamide
SMILESCCCCCCCC(=O)N=O
InChIInChI=1S/C8H15NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-7H2,1H3
InChIKeyGKOKWEVCYXCXST-UHFFFAOYSA-N
MW157.21 g/mol
LogP2.64
Rot. Bonds6

About N-oxooctanamide

N-oxooctanamide (PubChem CID 87234486) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-oxooctanamide.

Molecular Properties

Compound NameN-oxooctanamide
PubChem CID87234486
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-oxooctanamide
SMILESCCCCCCCC(=O)N=O
InChIInChI=1S/C8H15NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-7H2,1H3
InChIKeyGKOKWEVCYXCXST-UHFFFAOYSA-N
XLogP2.64
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-oxotetradecanamide
CID 87730431
N-oxobutanamide
CID 87293137
N-methylidenehexacosanamide
CID 89187174
N-sulfanylideneoctanamide
CID 58219363
N-methylidenedocosanamide
CID 175417802
8-bromo-N-oxooctanamide
CID 118895802
nonanoyl isothiocyanate
CID 19774855
N-propylideneundecanamide
CID 90933467
pentadecan-8-one
CID 13162
tricosan-12-one
CID 10888
nonatriacontane-16,17-dione
CID 175447711
nonadecan-7-one
CID 12913434

Frequently Asked Questions

What is the IUPAC name of N-oxooctanamide?
The IUPAC name of N-oxooctanamide (CID 87234486) is N-oxooctanamide.
What is the SMILES notation for N-oxooctanamide?
The canonical SMILES for N-oxooctanamide is CCCCCCCC(=O)N=O.
What is the InChIKey of N-oxooctanamide?
The InChIKey is GKOKWEVCYXCXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-7H2,1H3.
What are the key properties of N-oxooctanamide?
N-oxooctanamide has a molecular weight of 157.21 g/mol, XLogP of 2.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-oxooctanamide is sourced from PubChem (CID 87234486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).