2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide

C13H24N2O2 — CID 60714122

IUPAC2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NC(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2/c1-9(13(16)14-7-8-17-2)15-12(10-3-4-10)11-5-6-11/h9-12,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyLKHNSCFHUSJYOV-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.92
Rot. Bonds8

About 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide

2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide (PubChem CID 60714122) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide
PubChem CID60714122
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NC(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2/c1-9(13(16)14-7-8-17-2)15-12(10-3-4-10)11-5-6-11/h9-12,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyLKHNSCFHUSJYOV-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
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 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide (CID 60714122) is 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)NC(C1CC1)C1CC1.
What is the InChIKey of 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide?
The InChIKey is LKHNSCFHUSJYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9(13(16)14-7-8-17-2)15-12(10-3-4-10)11-5-6-11/h9-12,15H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide?
2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide has a molecular weight of 240.35 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dicyclopropylmethylamino)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 60714122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).