N,N,N',N'-tetraethylpropanediamide

C11H22N2O2 — CID 551770

IUPACN,N,N',N'-tetraethylpropanediamide
SMILESCCN(CC)C(=O)CC(=O)N(CC)CC
InChIInChI=1S/C11H22N2O2/c1-5-12(6-2)10(14)9-11(15)13(7-3)8-4/h5-9H2,1-4H3
InChIKeyRTHWPWJSSJEQNU-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.11
Rot. Bonds6

About N,N,N',N'-tetraethylpropanediamide

N,N,N',N'-tetraethylpropanediamide (PubChem CID 551770) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N,N,N',N'-tetraethylpropanediamide.

Molecular Properties

Compound NameN,N,N',N'-tetraethylpropanediamide
PubChem CID551770
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN,N,N',N'-tetraethylpropanediamide
SMILESCCN(CC)C(=O)CC(=O)N(CC)CC
InChIInChI=1S/C11H22N2O2/c1-5-12(6-2)10(14)9-11(15)13(7-3)8-4/h5-9H2,1-4H3
InChIKeyRTHWPWJSSJEQNU-UHFFFAOYSA-N
XLogP1.11
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze N,N,N',N'-tetraethylpropanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N,N',N'-tetraethylpropanediamide?
The IUPAC name of N,N,N',N'-tetraethylpropanediamide (CID 551770) is N,N,N',N'-tetraethylpropanediamide.
What is the SMILES notation for N,N,N',N'-tetraethylpropanediamide?
The canonical SMILES for N,N,N',N'-tetraethylpropanediamide is CCN(CC)C(=O)CC(=O)N(CC)CC.
What is the InChIKey of N,N,N',N'-tetraethylpropanediamide?
The InChIKey is RTHWPWJSSJEQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-5-12(6-2)10(14)9-11(15)13(7-3)8-4/h5-9H2,1-4H3.
What are the key properties of N,N,N',N'-tetraethylpropanediamide?
N,N,N',N'-tetraethylpropanediamide has a molecular weight of 214.31 g/mol, XLogP of 1.11, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N'-tetraethylpropanediamide is sourced from PubChem (CID 551770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).