N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide

C11H25N3O — CID 62839311

IUPACN-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide
SMILESCCNC(C)CC(=O)NCCCN(C)C
InChIInChI=1S/C11H25N3O/c1-5-12-10(2)9-11(15)13-7-6-8-14(3)4/h10,12H,5-9H2,1-4H3,(H,13,15)
InChIKeyKQXNVIJTEOXXGL-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.44
Rot. Bonds8

About N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide

N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide (PubChem CID 62839311) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide
PubChem CID62839311
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC NameN-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide
SMILESCCNC(C)CC(=O)NCCCN(C)C
InChIInChI=1S/C11H25N3O/c1-5-12-10(2)9-11(15)13-7-6-8-14(3)4/h10,12H,5-9H2,1-4H3,(H,13,15)
InChIKeyKQXNVIJTEOXXGL-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-3-(ethylamino)butanamide
CID 62838234
3-(ethylamino)-N-(5-hydroxypentyl)butanamide
CID 107317725
3-(ethylamino)-N-(4-propan-2-yloxybutyl)butanamide
CID 106011222
3-(ethylamino)-N',N'-dimethylbutanehydrazide
CID 83021084
3-(ethylamino)-N-(3-phenylpropyl)butanamide
CID 62839193
4-amino-N-[4-(dimethylamino)butyl]-3-methylbutanamide
CID 81086781
N,N'-bis[3-(dimethylamino)propyl]-2-dodecylbutanediamide
CID 54060083
N'-[3-(dimethylamino)propyl]-N-ethyloxamide
CID 45000040
N-(2,2-dimethylpropyl)-3-(ethylamino)butanamide
CID 62838899
1-[3-(dimethylamino)propyl]-3-ethylurea;hydrate
CID 175591595
N-[3-(dimethylamino)propyl]nonanamide
CID 3395805
3-[3-(ethylamino)butanoylamino]-2-methylpropanoic acid
CID 62833119

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide (CID 62839311) is N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide is CCNC(C)CC(=O)NCCCN(C)C.
What is the InChIKey of N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide?
The InChIKey is KQXNVIJTEOXXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-5-12-10(2)9-11(15)13-7-6-8-14(3)4/h10,12H,5-9H2,1-4H3,(H,13,15).
What are the key properties of N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide?
N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide has a molecular weight of 215.34 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-3-(ethylamino)butanamide is sourced from PubChem (CID 62839311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).