N-methoxy-5-oxopentanamide

C6H11NO3 — CID 91086399

IUPACN-methoxy-5-oxopentanamide
SMILESCONC(=O)CCCC=O
InChIInChI=1S/C6H11NO3/c1-10-7-6(9)4-2-3-5-8/h5H,2-4H2,1H3,(H,7,9)
InChIKeyGVJVPDAOSFVRKK-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.03
Rot. Bonds5

About N-methoxy-5-oxopentanamide

N-methoxy-5-oxopentanamide (PubChem CID 91086399) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is N-methoxy-5-oxopentanamide.

Molecular Properties

Compound NameN-methoxy-5-oxopentanamide
PubChem CID91086399
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC NameN-methoxy-5-oxopentanamide
SMILESCONC(=O)CCCC=O
InChIInChI=1S/C6H11NO3/c1-10-7-6(9)4-2-3-5-8/h5H,2-4H2,1H3,(H,7,9)
InChIKeyGVJVPDAOSFVRKK-UHFFFAOYSA-N
XLogP0.03
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methoxy-9-oxononanamide
CID 144851599
N-methoxy-4-oxobutanamide
CID 126994320
5-(methoxyamino)-5-oxopentanoic acid
CID 64974146
4-iodo-N-methoxybutanamide
CID 141466825
4-(methoxyamino)-4-oxobutanoic acid
CID 64974135
6-chloro-N-methoxyhexanamide
CID 90073847
N-ethyl-5-oxopentanamide
CID 54062498
[4-(methoxyamino)-4-oxobutyl]phosphonic acid
CID 71458600
N-methoxyicos-4-enamide
CID 173091875
methyl 13-oxotridecanoate
CID 10331995
methyl 10-oxodecanoate
CID 519005
N-methoxy-7-methyloctanamide
CID 174552254

Frequently Asked Questions

What is the IUPAC name of N-methoxy-5-oxopentanamide?
The IUPAC name of N-methoxy-5-oxopentanamide (CID 91086399) is N-methoxy-5-oxopentanamide.
What is the SMILES notation for N-methoxy-5-oxopentanamide?
The canonical SMILES for N-methoxy-5-oxopentanamide is CONC(=O)CCCC=O.
What is the InChIKey of N-methoxy-5-oxopentanamide?
The InChIKey is GVJVPDAOSFVRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-10-7-6(9)4-2-3-5-8/h5H,2-4H2,1H3,(H,7,9).
What are the key properties of N-methoxy-5-oxopentanamide?
N-methoxy-5-oxopentanamide has a molecular weight of 145.16 g/mol, XLogP of 0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-5-oxopentanamide is sourced from PubChem (CID 91086399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).