N'-ethylpropanediamide

C5H10N2O2 — CID 14686248

IUPACN'-ethylpropanediamide
SMILESCCNC(=O)CC(N)=O
InChIInChI=1S/C5H10N2O2/c1-2-7-5(9)3-4(6)8/h2-3H2,1H3,(H2,6,8)(H,7,9)
InChIKeyIVMIXRFCJQZPCS-UHFFFAOYSA-N
MW130.15 g/mol
LogP-1.00
Rot. Bonds3

About N'-ethylpropanediamide

N'-ethylpropanediamide (PubChem CID 14686248) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is N'-ethylpropanediamide.

Molecular Properties

Compound NameN'-ethylpropanediamide
PubChem CID14686248
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC NameN'-ethylpropanediamide
SMILESCCNC(=O)CC(N)=O
InChIInChI=1S/C5H10N2O2/c1-2-7-5(9)3-4(6)8/h2-3H2,1H3,(H2,6,8)(H,7,9)
InChIKeyIVMIXRFCJQZPCS-UHFFFAOYSA-N
XLogP-1.00
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Ethylpropionamide
CID 521324
Dioxocyclam
CID 196413
N-[4-(propanoylamino)butyl]propanamide
CID 2167047
N-Ethyl-3-oxobutanamide
CID 24988
N-(3-aminopropyl)acetamide
CID 13793967
3-Amino-N-methylpropanamide
CID 14889074
N-methyl-3-(methylamino)propanamide
CID 12548977
N,N'-Dimethylmalonamide
CID 192755
N-(3-acetamidopropyl)acetamide
CID 5147555
N-Propylpropanamide
CID 347476
Acetic acid, 1-(3-amino-3-oxopropyl)-2,2-dimethylhydrazide
CID 3024685
N(1)-Acetylnorspermidine
CID 129852

Frequently Asked Questions

What is the IUPAC name of N'-ethylpropanediamide?
The IUPAC name of N'-ethylpropanediamide (CID 14686248) is N'-ethylpropanediamide.
What is the SMILES notation for N'-ethylpropanediamide?
The canonical SMILES for N'-ethylpropanediamide is CCNC(=O)CC(N)=O.
What is the InChIKey of N'-ethylpropanediamide?
The InChIKey is IVMIXRFCJQZPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-2-7-5(9)3-4(6)8/h2-3H2,1H3,(H2,6,8)(H,7,9).
What are the key properties of N'-ethylpropanediamide?
N'-ethylpropanediamide has a molecular weight of 130.15 g/mol, XLogP of -1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethylpropanediamide is sourced from PubChem (CID 14686248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).