4-(ethylamino)-N,N-dimethylbutanamide

C8H18N2O — CID 3024993

IUPAC4-(ethylamino)-N,N-dimethylbutanamide
SMILESCCNCCCC(=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-4-9-7-5-6-8(11)10(2)3/h9H,4-7H2,1-3H3
InChIKeyOOZJYBSMVRCXHM-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.46
Rot. Bonds5

About 4-(ethylamino)-N,N-dimethylbutanamide

4-(ethylamino)-N,N-dimethylbutanamide (PubChem CID 3024993) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 4-(ethylamino)-N,N-dimethylbutanamide.

Molecular Properties

Compound Name4-(ethylamino)-N,N-dimethylbutanamide
PubChem CID3024993
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name4-(ethylamino)-N,N-dimethylbutanamide
SMILESCCNCCCC(=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-4-9-7-5-6-8(11)10(2)3/h9H,4-7H2,1-3H3
InChIKeyOOZJYBSMVRCXHM-UHFFFAOYSA-N
XLogP0.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(ethylamino)-N,N-dimethylpropanamide
CID 60926487
4-(ethylamino)-N-methylbutanehydrazide
CID 167290600
4-(ethylamino)-N-methyl-N-(2-methylpropyl)butanamide
CID 155599481
N,N-dimethyl-4-(2-methylsulfanylethylamino)butanamide
CID 63965989
N,N-dimethyl-4-(methylamino)butanamide;ethane
CID 163270647
4-(ethoxyamino)-N,N-dimethylbutanamide
CID 64974940
4-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylbutanamide
CID 105416919
4-[(1-ethylcyclopentyl)methylamino]-N,N-dimethylbutanamide
CID 114125198
4-[(4-hydroxycyclohexyl)methylamino]-N,N-dimethylbutanamide
CID 106133750
N,N-dimethyl-4-(methylcarbamoylamino)butanamide
CID 59006534
N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]butanamide
CID 113411347
4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-N,N-dimethylbutanamide
CID 62843976

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N,N-dimethylbutanamide?
The IUPAC name of 4-(ethylamino)-N,N-dimethylbutanamide (CID 3024993) is 4-(ethylamino)-N,N-dimethylbutanamide.
What is the SMILES notation for 4-(ethylamino)-N,N-dimethylbutanamide?
The canonical SMILES for 4-(ethylamino)-N,N-dimethylbutanamide is CCNCCCC(=O)N(C)C.
What is the InChIKey of 4-(ethylamino)-N,N-dimethylbutanamide?
The InChIKey is OOZJYBSMVRCXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-4-9-7-5-6-8(11)10(2)3/h9H,4-7H2,1-3H3.
What are the key properties of 4-(ethylamino)-N,N-dimethylbutanamide?
4-(ethylamino)-N,N-dimethylbutanamide has a molecular weight of 158.24 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N,N-dimethylbutanamide is sourced from PubChem (CID 3024993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).