N-methyl-3-(methylamino)butanamide

C6H14N2O — CID 21051523

IUPACN-methyl-3-(methylamino)butanamide
SMILESCNC(=O)CC(C)NC
InChIInChI=1S/C6H14N2O/c1-5(7-2)4-6(9)8-3/h5,7H,4H2,1-3H3,(H,8,9)
InChIKeyZPVCSLQZDVRAPF-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.27
Rot. Bonds3

About N-methyl-3-(methylamino)butanamide

N-methyl-3-(methylamino)butanamide (PubChem CID 21051523) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is N-methyl-3-(methylamino)butanamide.

Molecular Properties

Compound NameN-methyl-3-(methylamino)butanamide
PubChem CID21051523
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC NameN-methyl-3-(methylamino)butanamide
SMILESCNC(=O)CC(C)NC
InChIInChI=1S/C6H14N2O/c1-5(7-2)4-6(9)8-3/h5,7H,4H2,1-3H3,(H,8,9)
InChIKeyZPVCSLQZDVRAPF-UHFFFAOYSA-N
XLogP-0.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-3-(methylamino)butanamide 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-methyl-3-(methylamino)butanamide?
The IUPAC name of N-methyl-3-(methylamino)butanamide (CID 21051523) is N-methyl-3-(methylamino)butanamide.
What is the SMILES notation for N-methyl-3-(methylamino)butanamide?
The canonical SMILES for N-methyl-3-(methylamino)butanamide is CNC(=O)CC(C)NC.
What is the InChIKey of N-methyl-3-(methylamino)butanamide?
The InChIKey is ZPVCSLQZDVRAPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-5(7-2)4-6(9)8-3/h5,7H,4H2,1-3H3,(H,8,9).
What are the key properties of N-methyl-3-(methylamino)butanamide?
N-methyl-3-(methylamino)butanamide has a molecular weight of 130.19 g/mol, XLogP of -0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(methylamino)butanamide is sourced from PubChem (CID 21051523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).