2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide

C11H24N2O2 — CID 81081261

IUPAC2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide
SMILESCCN(C(=O)C(N)CCCOC)C(C)C
InChIInChI=1S/C11H24N2O2/c1-5-13(9(2)3)11(14)10(12)7-6-8-15-4/h9-10H,5-8,12H2,1-4H3
InChIKeyRQZPLPRHBJVUHH-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.00
Rot. Bonds7

About 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide

2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide (PubChem CID 81081261) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide
PubChem CID81081261
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide
SMILESCCN(C(=O)C(N)CCCOC)C(C)C
InChIInChI=1S/C11H24N2O2/c1-5-13(9(2)3)11(14)10(12)7-6-8-15-4/h9-10H,5-8,12H2,1-4H3
InChIKeyRQZPLPRHBJVUHH-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.00
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 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide?
The IUPAC name of 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide (CID 81081261) is 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide.
What is the SMILES notation for 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide?
The canonical SMILES for 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide is CCN(C(=O)C(N)CCCOC)C(C)C.
What is the InChIKey of 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide?
The InChIKey is RQZPLPRHBJVUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-13(9(2)3)11(14)10(12)7-6-8-15-4/h9-10H,5-8,12H2,1-4H3.
What are the key properties of 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide?
2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide has a molecular weight of 216.32 g/mol, XLogP of 1.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide is sourced from PubChem (CID 81081261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).