4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide

C13H27N3O — CID 105416919

IUPAC4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CCCNCC1(N(C)C)CCC1
InChIInChI=1S/C13H27N3O/c1-15(2)12(17)7-5-10-14-11-13(16(3)4)8-6-9-13/h14H,5-11H2,1-4H3
InChIKeyZHYZNLFTWVNJIK-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.93
Rot. Bonds7

About 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide

4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide (PubChem CID 105416919) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide.

Molecular Properties

Compound Name4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide
PubChem CID105416919
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide
SMILESCN(C)C(=O)CCCNCC1(N(C)C)CCC1
InChIInChI=1S/C13H27N3O/c1-15(2)12(17)7-5-10-14-11-13(16(3)4)8-6-9-13/h14H,5-11H2,1-4H3
InChIKeyZHYZNLFTWVNJIK-UHFFFAOYSA-N
XLogP0.93
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide 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

methyl 4-[[1-(dimethylamino)cyclobutyl]methylamino]butanoate
CID 105416398
methyl 4-[[1-(dimethylamino)cyclopentyl]methylamino]butanoate
CID 83121631
5-[[1-(dimethylamino)cyclopentyl]methylamino]pentanoic acid
CID 103262326
4-[(1-ethylcyclopentyl)methylamino]-N,N-dimethylbutanamide
CID 114125198
3-[[1-(dimethylamino)cyclobutyl]methylamino]propanoic acid
CID 105416372
4-[[1-(hydroxymethyl)cyclohexyl]methylamino]-N,N-dimethylbutanamide
CID 113359635
4-(ethylamino)-N,N-dimethylbutanamide
CID 3024993
N-[[1-(dimethylamino)cyclobutyl]methyl]-N',N'-dimethylpropane-1,3-diamine
CID 105416972
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-4-(methylamino)butanamide
CID 105417667
N,N-dimethyl-4-(methylamino)butanamide;ethane
CID 163270647
N,N-dimethyl-1-[(3-methylsulfanylpropylamino)methyl]cyclohexan-1-amine
CID 28622139
3-[[1-(dimethylamino)cyclobutyl]methylamino]-N'-hydroxypropanimidamide
CID 105418384

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide?
The IUPAC name of 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide (CID 105416919) is 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide.
What is the SMILES notation for 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide?
The canonical SMILES for 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide is CN(C)C(=O)CCCNCC1(N(C)C)CCC1.
What is the InChIKey of 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide?
The InChIKey is ZHYZNLFTWVNJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-15(2)12(17)7-5-10-14-11-13(16(3)4)8-6-9-13/h14H,5-11H2,1-4H3.
What are the key properties of 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide?
4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide has a molecular weight of 241.38 g/mol, XLogP of 0.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide is sourced from PubChem (CID 105416919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).