2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide

C11H25N3O — CID 43116469

IUPAC2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)N(C)CCCN
InChIInChI=1S/C11H25N3O/c1-5-14(6-2)11(15)10(3)13(4)9-7-8-12/h10H,5-9,12H2,1-4H3
InChIKeyULZXPQFIRFXUAR-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.52
Rot. Bonds7

About 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide

2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide (PubChem CID 43116469) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide
PubChem CID43116469
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)N(C)CCCN
InChIInChI=1S/C11H25N3O/c1-5-14(6-2)11(15)10(3)13(4)9-7-8-12/h10H,5-9,12H2,1-4H3
InChIKeyULZXPQFIRFXUAR-UHFFFAOYSA-N
XLogP0.52
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide?
The IUPAC name of 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide (CID 43116469) is 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide.
What is the SMILES notation for 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide?
The canonical SMILES for 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)N(C)CCCN.
What is the InChIKey of 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide?
The InChIKey is ULZXPQFIRFXUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-5-14(6-2)11(15)10(3)13(4)9-7-8-12/h10H,5-9,12H2,1-4H3.
What are the key properties of 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide?
2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide has a molecular weight of 215.34 g/mol, XLogP of 0.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide is sourced from PubChem (CID 43116469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).