2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide

C12H25N3O — CID 105416686

IUPAC2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide
SMILESCC(NCC1(N(C)C)CCC1)C(=O)N(C)C
InChIInChI=1S/C12H25N3O/c1-10(11(16)14(2)3)13-9-12(15(4)5)7-6-8-12/h10,13H,6-9H2,1-5H3
InChIKeyIRKRNAVPCYXJMS-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.54
Rot. Bonds5

About 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide

2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide (PubChem CID 105416686) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide
PubChem CID105416686
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide
SMILESCC(NCC1(N(C)C)CCC1)C(=O)N(C)C
InChIInChI=1S/C12H25N3O/c1-10(11(16)14(2)3)13-9-12(15(4)5)7-6-8-12/h10,13H,6-9H2,1-5H3
InChIKeyIRKRNAVPCYXJMS-UHFFFAOYSA-N
XLogP0.54
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-[[1-(dimethylamino)cyclobutyl]methylamino]propanamide
CID 105416383
methyl 2-[[1-(dimethylamino)cyclopentyl]methylamino]propanoate
CID 83107449
2-[(1-hydroxycycloheptyl)methylamino]-N,N-dimethylpropanamide
CID 54950879
ethyl 2-[[1-(dimethylamino)cyclopentyl]methylamino]propanoate
CID 83121065
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N,N-dimethylpropanamide
CID 115359532
1-[[1-(dimethylamino)cyclobutyl]methyl]-3-propan-2-ylurea
CID 105408997
3-[[1-(dimethylamino)cyclopentyl]methylamino]butanoic acid
CID 83121061
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(2-methylbutan-2-yl)propanamide
CID 83121707
methyl 2-[[1-(dimethylamino)cyclobutyl]methylamino]butanoate
CID 105415620
2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
CID 106100495
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methoxypropanamide
CID 105420622
propan-2-yl 2-[[1-(dimethylamino)cyclobutyl]methylamino]acetate
CID 105416997

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide (CID 105416686) is 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide is CC(NCC1(N(C)C)CCC1)C(=O)N(C)C.
What is the InChIKey of 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide?
The InChIKey is IRKRNAVPCYXJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-10(11(16)14(2)3)13-9-12(15(4)5)7-6-8-12/h10,13H,6-9H2,1-5H3.
What are the key properties of 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide?
2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide has a molecular weight of 227.35 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 105416686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).