N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide

C9H19N3O2 — CID 154666633

IUPACN'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide
SMILESCNC(=O)C(=O)N(C)CCCN(C)C
InChIInChI=1S/C9H19N3O2/c1-10-8(13)9(14)12(4)7-5-6-11(2)3/h5-7H2,1-4H3,(H,10,13)
InChIKeyGOOPYNMUCXASPZ-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.86
Rot. Bonds4

About N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide

N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide (PubChem CID 154666633) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide.

Molecular Properties

Compound NameN'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide
PubChem CID154666633
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide
SMILESCNC(=O)C(=O)N(C)CCCN(C)C
InChIInChI=1S/C9H19N3O2/c1-10-8(13)9(14)12(4)7-5-6-11(2)3/h5-7H2,1-4H3,(H,10,13)
InChIKeyGOOPYNMUCXASPZ-UHFFFAOYSA-N
XLogP-0.86
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis[3-(dimethylamino)propyl]-N,N'-dimethyl-3-oxopentanediamide
CID 20664951
N-[8-(dimethylamino)octyl]-N-methyl-2-(methylamino)acetamide
CID 54022406
6-(dimethylamino)-N-methylhexanamide
CID 58019688
N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
CID 79191572
N'-butyl-N'-methyl-N-(2,4,4-trimethylpentan-2-yl)oxamide
CID 108526227
N-[3-(dimethylamino)propyl]-2-(ethylamino)-N,2-dimethylpropanamide
CID 63693670
4-[3-(dimethylamino)propyl-methylamino]-4-oxobut-2-enoic acid
CID 77017356
N-[3-(dimethylamino)propyl]-2-ethoxy-N-methylacetamide
CID 64591351
N-[3-(dimethylamino)propyl]-N-methylprop-2-enamide;hydrazine
CID 162091587
5-(dimethylamino)-N,2-dimethylpentanamide
CID 123779216
6-(dimethylamino)-3-oxohexanoic acid
CID 174931957
(Z)-2-[(dimethylamino)methyl]-N-methylbut-2-enamide
CID 172623936

Frequently Asked Questions

What is the IUPAC name of N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide?
The IUPAC name of N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide (CID 154666633) is N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide.
What is the SMILES notation for N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide?
The canonical SMILES for N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide is CNC(=O)C(=O)N(C)CCCN(C)C.
What is the InChIKey of N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide?
The InChIKey is GOOPYNMUCXASPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-10-8(13)9(14)12(4)7-5-6-11(2)3/h5-7H2,1-4H3,(H,10,13).
What are the key properties of N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide?
N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide has a molecular weight of 201.27 g/mol, XLogP of -0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(dimethylamino)propyl]-N,N'-dimethyloxamide is sourced from PubChem (CID 154666633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).