N-(2-acetamidobutyl)acetamide

C8H16N2O2 — CID 547374

IUPACN-(2-acetamidobutyl)acetamide
SMILESCCC(CNC(C)=O)NC(C)=O
InChIInChI=1S/C8H16N2O2/c1-4-8(10-7(3)12)5-9-6(2)11/h8H,4-5H2,1-3H3,(H,9,11)(H,10,12)
InChIKeyOIPKOJIURSMLCM-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.04
Rot. Bonds4

About N-(2-acetamidobutyl)acetamide

N-(2-acetamidobutyl)acetamide (PubChem CID 547374) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-(2-acetamidobutyl)acetamide.

Molecular Properties

Compound NameN-(2-acetamidobutyl)acetamide
PubChem CID547374
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-(2-acetamidobutyl)acetamide
SMILESCCC(CNC(C)=O)NC(C)=O
InChIInChI=1S/C8H16N2O2/c1-4-8(10-7(3)12)5-9-6(2)11/h8H,4-5H2,1-3H3,(H,9,11)(H,10,12)
InChIKeyOIPKOJIURSMLCM-UHFFFAOYSA-N
XLogP0.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-acetamidobutyl)acetamide 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

N8-Acetylspermidine
CID 123689
N1-Acetylspermidine
CID 496
N1,N12-Diacetylspermine
CID 132680
N-(5-(Acetylamino)pentylene)acetamide
CID 100784
L-Alanylglycinamide
CID 7019037
(2S)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]propanamide
CID 10989432
N-[4-(propanoylamino)butyl]propanamide
CID 2167047
N,N'-Dipropyloxamide
CID 123335
2-Amino-N-isopropylacetamide
CID 533849
N(1)-acetylspermidinium(2+)
CID 25203502
N-(Carbamoylmethyl)-2-acetamido-3-methylbutanamide
CID 644829
N-[2-(hexanoylamino)propyl]hexanamide
CID 4431095

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidobutyl)acetamide?
The IUPAC name of N-(2-acetamidobutyl)acetamide (CID 547374) is N-(2-acetamidobutyl)acetamide.
What is the SMILES notation for N-(2-acetamidobutyl)acetamide?
The canonical SMILES for N-(2-acetamidobutyl)acetamide is CCC(CNC(C)=O)NC(C)=O.
What is the InChIKey of N-(2-acetamidobutyl)acetamide?
The InChIKey is OIPKOJIURSMLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-4-8(10-7(3)12)5-9-6(2)11/h8H,4-5H2,1-3H3,(H,9,11)(H,10,12).
What are the key properties of N-(2-acetamidobutyl)acetamide?
N-(2-acetamidobutyl)acetamide has a molecular weight of 172.23 g/mol, XLogP of 0.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidobutyl)acetamide is sourced from PubChem (CID 547374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).