5-(3-methoxypropoxy)pentanamide

C9H19NO3 — CID 135179275

IUPAC5-(3-methoxypropoxy)pentanamide
SMILESCOCCCOCCCCC(N)=O
InChIInChI=1S/C9H19NO3/c1-12-6-4-8-13-7-3-2-5-9(10)11/h2-8H2,1H3,(H2,10,11)
InChIKeyNIYHWGGJFDHLAH-UHFFFAOYSA-N
MW189.25 g/mol
LogP0.70
Rot. Bonds9

About 5-(3-methoxypropoxy)pentanamide

5-(3-methoxypropoxy)pentanamide (PubChem CID 135179275) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 5-(3-methoxypropoxy)pentanamide.

Molecular Properties

Compound Name5-(3-methoxypropoxy)pentanamide
PubChem CID135179275
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name5-(3-methoxypropoxy)pentanamide
SMILESCOCCCOCCCCC(N)=O
InChIInChI=1S/C9H19NO3/c1-12-6-4-8-13-7-3-2-5-9(10)11/h2-8H2,1H3,(H2,10,11)
InChIKeyNIYHWGGJFDHLAH-UHFFFAOYSA-N
XLogP0.70
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 50.70
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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Related Compounds

4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]butanamide
CID 122695577
ethane;3-[4-(2-methoxyethoxy)butoxy]propanamide
CID 177319137
2-[3-(4-methoxybutoxy)propoxy]acetamide
CID 142367848
4-methoxybutanamide
CID 22414177
4-methoxybutanamide;hydrochloride
CID 141117964
N'-hydroxy-5-(3-methoxypropoxy)pentanimidamide
CID 109374764
ethyl 6-[2-(3-methoxypropoxy)ethoxy]hexanoate
CID 103176658
6-[2-(3-methoxypropoxy)ethoxy]hexanehydrazide
CID 103175984
4-(3-methoxypropoxy)butanoic acid
CID 60918159
hexanediamide;methoxymethane
CID 87287786
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
4-(3-methoxypropoxy)butanethioamide
CID 60917615

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxypropoxy)pentanamide?
The IUPAC name of 5-(3-methoxypropoxy)pentanamide (CID 135179275) is 5-(3-methoxypropoxy)pentanamide.
What is the SMILES notation for 5-(3-methoxypropoxy)pentanamide?
The canonical SMILES for 5-(3-methoxypropoxy)pentanamide is COCCCOCCCCC(N)=O.
What is the InChIKey of 5-(3-methoxypropoxy)pentanamide?
The InChIKey is NIYHWGGJFDHLAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-12-6-4-8-13-7-3-2-5-9(10)11/h2-8H2,1H3,(H2,10,11).
What are the key properties of 5-(3-methoxypropoxy)pentanamide?
5-(3-methoxypropoxy)pentanamide has a molecular weight of 189.25 g/mol, XLogP of 0.70, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxypropoxy)pentanamide is sourced from PubChem (CID 135179275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).