5-oxoheptanamide

C7H13NO2 — CID 54102648

IUPAC5-oxoheptanamide
SMILESCCC(=O)CCCC(N)=O
InChIInChI=1S/C7H13NO2/c1-2-6(9)4-3-5-7(8)10/h2-5H2,1H3,(H2,8,10)
InChIKeyRJSZTLGADDVJPF-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.62
Rot. Bonds5

About 5-oxoheptanamide

5-oxoheptanamide (PubChem CID 54102648) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 5-oxoheptanamide.

Molecular Properties

Compound Name5-oxoheptanamide
PubChem CID54102648
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name5-oxoheptanamide
SMILESCCC(=O)CCCC(N)=O
InChIInChI=1S/C7H13NO2/c1-2-6(9)4-3-5-7(8)10/h2-5H2,1H3,(H2,8,10)
InChIKeyRJSZTLGADDVJPF-UHFFFAOYSA-N
XLogP0.62
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-oxoheptanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

heptadecane-3,7,11,15-tetrone
CID 160942813
methane;undecane-3,9-dione
CID 158816586
4-methylpentanoyl fluoride;6-oxooctanamide
CID 145408347
14-aminotetradecan-3-one
CID 178176766
1-hydroxydodecane-2,10-dione
CID 158814981
2-(5-oxoheptyl)guanidine
CID 89070451
hexacosane-3,6,9,12,15,18,21,24-octone
CID 175857763
(E)-5-oxotetradec-9-enamide
CID 5370333
4-oxotetradecanamide
CID 176888940
tetracosane-3,13-dione
CID 143607999
9-oxoundecanoic acid
CID 5282986
decan-3-one;hydrochloride
CID 22446547

Frequently Asked Questions

What is the IUPAC name of 5-oxoheptanamide?
The IUPAC name of 5-oxoheptanamide (CID 54102648) is 5-oxoheptanamide.
What is the SMILES notation for 5-oxoheptanamide?
The canonical SMILES for 5-oxoheptanamide is CCC(=O)CCCC(N)=O.
What is the InChIKey of 5-oxoheptanamide?
The InChIKey is RJSZTLGADDVJPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-6(9)4-3-5-7(8)10/h2-5H2,1H3,(H2,8,10).
What are the key properties of 5-oxoheptanamide?
5-oxoheptanamide has a molecular weight of 143.19 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxoheptanamide is sourced from PubChem (CID 54102648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).