N-cyclopropyl-4-methoxy-N-propylbutanamide

C11H21NO2 — CID 59224152

IUPACN-cyclopropyl-4-methoxy-N-propylbutanamide
SMILESCCCN(C(=O)CCCOC)C1CC1
InChIInChI=1S/C11H21NO2/c1-3-8-12(10-6-7-10)11(13)5-4-9-14-2/h10H,3-9H2,1-2H3
InChIKeyGSPUJSUWAWISLF-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.81
Rot. Bonds7

About N-cyclopropyl-4-methoxy-N-propylbutanamide

N-cyclopropyl-4-methoxy-N-propylbutanamide (PubChem CID 59224152) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-cyclopropyl-4-methoxy-N-propylbutanamide.

Molecular Properties

Compound NameN-cyclopropyl-4-methoxy-N-propylbutanamide
PubChem CID59224152
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-cyclopropyl-4-methoxy-N-propylbutanamide
SMILESCCCN(C(=O)CCCOC)C1CC1
InChIInChI=1S/C11H21NO2/c1-3-8-12(10-6-7-10)11(13)5-4-9-14-2/h10H,3-9H2,1-2H3
InChIKeyGSPUJSUWAWISLF-UHFFFAOYSA-N
XLogP1.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.81
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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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methoxy-N-propylbutanamide?
The IUPAC name of N-cyclopropyl-4-methoxy-N-propylbutanamide (CID 59224152) is N-cyclopropyl-4-methoxy-N-propylbutanamide.
What is the SMILES notation for N-cyclopropyl-4-methoxy-N-propylbutanamide?
The canonical SMILES for N-cyclopropyl-4-methoxy-N-propylbutanamide is CCCN(C(=O)CCCOC)C1CC1.
What is the InChIKey of N-cyclopropyl-4-methoxy-N-propylbutanamide?
The InChIKey is GSPUJSUWAWISLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-8-12(10-6-7-10)11(13)5-4-9-14-2/h10H,3-9H2,1-2H3.
What are the key properties of N-cyclopropyl-4-methoxy-N-propylbutanamide?
N-cyclopropyl-4-methoxy-N-propylbutanamide has a molecular weight of 199.29 g/mol, XLogP of 1.81, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methoxy-N-propylbutanamide is sourced from PubChem (CID 59224152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).