5-methoxy-N-(2-methoxyethyl)pentanamide

C9H19NO3 — CID 58281484

IUPAC5-methoxy-N-(2-methoxyethyl)pentanamide
SMILESCOCCCCC(=O)NCCOC
InChIInChI=1S/C9H19NO3/c1-12-7-4-3-5-9(11)10-6-8-13-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyDCBDRILBTGCPKU-UHFFFAOYSA-N
MW189.25 g/mol
LogP0.57
Rot. Bonds8

About 5-methoxy-N-(2-methoxyethyl)pentanamide

5-methoxy-N-(2-methoxyethyl)pentanamide (PubChem CID 58281484) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 5-methoxy-N-(2-methoxyethyl)pentanamide.

Molecular Properties

Compound Name5-methoxy-N-(2-methoxyethyl)pentanamide
PubChem CID58281484
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name5-methoxy-N-(2-methoxyethyl)pentanamide
SMILESCOCCCCC(=O)NCCOC
InChIInChI=1S/C9H19NO3/c1-12-7-4-3-5-9(11)10-6-8-13-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyDCBDRILBTGCPKU-UHFFFAOYSA-N
XLogP0.57
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(2-methoxyethyl)pentanamide?
The IUPAC name of 5-methoxy-N-(2-methoxyethyl)pentanamide (CID 58281484) is 5-methoxy-N-(2-methoxyethyl)pentanamide.
What is the SMILES notation for 5-methoxy-N-(2-methoxyethyl)pentanamide?
The canonical SMILES for 5-methoxy-N-(2-methoxyethyl)pentanamide is COCCCCC(=O)NCCOC.
What is the InChIKey of 5-methoxy-N-(2-methoxyethyl)pentanamide?
The InChIKey is DCBDRILBTGCPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-12-7-4-3-5-9(11)10-6-8-13-2/h3-8H2,1-2H3,(H,10,11).
What are the key properties of 5-methoxy-N-(2-methoxyethyl)pentanamide?
5-methoxy-N-(2-methoxyethyl)pentanamide has a molecular weight of 189.25 g/mol, XLogP of 0.57, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(2-methoxyethyl)pentanamide is sourced from PubChem (CID 58281484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).