N'-ethylbutanediamide

C6H12N2O2 — CID 15470086

IUPACN'-ethylbutanediamide
SMILESCCNC(=O)CCC(N)=O
InChIInChI=1S/C6H12N2O2/c1-2-8-6(10)4-3-5(7)9/h2-4H2,1H3,(H2,7,9)(H,8,10)
InChIKeyUGRUYRMDXYZLKY-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.61
Rot. Bonds4

About N'-ethylbutanediamide

N'-ethylbutanediamide (PubChem CID 15470086) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is N'-ethylbutanediamide.

Molecular Properties

Compound NameN'-ethylbutanediamide
PubChem CID15470086
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC NameN'-ethylbutanediamide
SMILESCCNC(=O)CCC(N)=O
InChIInChI=1S/C6H12N2O2/c1-2-8-6(10)4-3-5(7)9/h2-4H2,1H3,(H2,7,9)(H,8,10)
InChIKeyUGRUYRMDXYZLKY-UHFFFAOYSA-N
XLogP-0.61
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N'-ethylbutanediamide with MolForge

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

Launch Full Analysis

Related Compounds

N-Acetylputrescine
CID 122356
4-Acetamidobutanal
CID 440850
N-butylbutanamide
CID 347960
N-acetylputrescinium
CID 25243990
N-[4-(propanoylamino)butyl]propanamide
CID 2167047
N-[2-(butanoylamino)ethyl]butanamide
CID 280045
N-(3-acetamidopropyl)acetamide
CID 5147555
Butanamide, N-propyl-
CID 231083
N-Ethylbutanamide
CID 518695
N-Butylpropanamide
CID 221431
N-[4-(butanoylamino)butyl]butanamide
CID 2166864
Butanamide, N-(4-amino-4-oxobutyl)-
CID 3067787

Frequently Asked Questions

What is the IUPAC name of N'-ethylbutanediamide?
The IUPAC name of N'-ethylbutanediamide (CID 15470086) is N'-ethylbutanediamide.
What is the SMILES notation for N'-ethylbutanediamide?
The canonical SMILES for N'-ethylbutanediamide is CCNC(=O)CCC(N)=O.
What is the InChIKey of N'-ethylbutanediamide?
The InChIKey is UGRUYRMDXYZLKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-2-8-6(10)4-3-5(7)9/h2-4H2,1H3,(H2,7,9)(H,8,10).
What are the key properties of N'-ethylbutanediamide?
N'-ethylbutanediamide has a molecular weight of 144.17 g/mol, XLogP of -0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethylbutanediamide is sourced from PubChem (CID 15470086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).