2-(3-ethoxypropylamino)-N-propylacetamide

C10H22N2O2 — CID 28584599

IUPAC2-(3-ethoxypropylamino)-N-propylacetamide
SMILESCCCNC(=O)CNCCCOCC
InChIInChI=1S/C10H22N2O2/c1-3-6-12-10(13)9-11-7-5-8-14-4-2/h11H,3-9H2,1-2H3,(H,12,13)
InChIKeyRLMLYEICJULHFQ-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.53
Rot. Bonds9

About 2-(3-ethoxypropylamino)-N-propylacetamide

2-(3-ethoxypropylamino)-N-propylacetamide (PubChem CID 28584599) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-(3-ethoxypropylamino)-N-propylacetamide.

Molecular Properties

Compound Name2-(3-ethoxypropylamino)-N-propylacetamide
PubChem CID28584599
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-(3-ethoxypropylamino)-N-propylacetamide
SMILESCCCNC(=O)CNCCCOCC
InChIInChI=1S/C10H22N2O2/c1-3-6-12-10(13)9-11-7-5-8-14-4-2/h11H,3-9H2,1-2H3,(H,12,13)
InChIKeyRLMLYEICJULHFQ-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.53
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-(3-ethoxypropylamino)-N-propylacetamide?
The IUPAC name of 2-(3-ethoxypropylamino)-N-propylacetamide (CID 28584599) is 2-(3-ethoxypropylamino)-N-propylacetamide.
What is the SMILES notation for 2-(3-ethoxypropylamino)-N-propylacetamide?
The canonical SMILES for 2-(3-ethoxypropylamino)-N-propylacetamide is CCCNC(=O)CNCCCOCC.
What is the InChIKey of 2-(3-ethoxypropylamino)-N-propylacetamide?
The InChIKey is RLMLYEICJULHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-6-12-10(13)9-11-7-5-8-14-4-2/h11H,3-9H2,1-2H3,(H,12,13).
What are the key properties of 2-(3-ethoxypropylamino)-N-propylacetamide?
2-(3-ethoxypropylamino)-N-propylacetamide has a molecular weight of 202.30 g/mol, XLogP of 0.53, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxypropylamino)-N-propylacetamide is sourced from PubChem (CID 28584599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).