4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide

C12H28N4O — CID 103190946

IUPAC4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)C(C)CN(C)C
InChIInChI=1S/C12H28N4O/c1-6-16(10(2)9-15(4)5)8-7-11(14-3)12(13)17/h10-11,14H,6-9H2,1-5H3,(H2,13,17)
InChIKeyGLZUNENUKSLCDS-UHFFFAOYSA-N
MW244.38 g/mol
LogP-0.28
Rot. Bonds9

About 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide

4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide (PubChem CID 103190946) has the molecular formula C12H28N4O and a molecular weight of 244.38 g/mol. Its IUPAC name is 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide.

Molecular Properties

Compound Name4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide
PubChem CID103190946
Molecular FormulaC12H28N4O
Molecular Weight244.38 g/mol
Exact Mass244.23
IUPAC Name4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)C(C)CN(C)C
InChIInChI=1S/C12H28N4O/c1-6-16(10(2)9-15(4)5)8-7-11(14-3)12(13)17/h10-11,14H,6-9H2,1-5H3,(H2,13,17)
InChIKeyGLZUNENUKSLCDS-UHFFFAOYSA-N
XLogP-0.28
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]propanamide
CID 10989432
(S)-2,4-Diamino-N-pentyl-butyramide
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(2,4-Diamino-4-oxobutyl)-trimethylazanium
CID 13393128
2,4-Diamino-1-(piperazin-1-yl)butan-1-one
CID 44364252
N-{3-[Di(propan-2-yl)amino]propyl}-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374738
2-(Ethylamino)-N,N-dimethylbutyramide
CID 3020137
N,N-Dimethyl-2-(propylamino)butyramide
CID 3020138
2-[2-(1-Carbamoylpropylamino)ethylamino]butanamide
CID 469946
Dephenol-ptx-4.3.3
CID 131687
Asparaginyl-alanyl-glycyl-alaninamide
CID 134807
N,N'-di(8-carbamoylethyl)ethylenediamine
CID 56999259
Ethyl-l-aspartamide
CID 67184360

Frequently Asked Questions

What is the IUPAC name of 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide?
The IUPAC name of 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide (CID 103190946) is 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide.
What is the SMILES notation for 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide?
The canonical SMILES for 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide is CCN(CCC(NC)C(N)=O)C(C)CN(C)C.
What is the InChIKey of 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide?
The InChIKey is GLZUNENUKSLCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N4O/c1-6-16(10(2)9-15(4)5)8-7-11(14-3)12(13)17/h10-11,14H,6-9H2,1-5H3,(H2,13,17).
What are the key properties of 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide?
4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide has a molecular weight of 244.38 g/mol, XLogP of -0.28, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide is sourced from PubChem (CID 103190946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).