N-butyl-2-(diethylamino)acetamide

C10H22N2O — CID 54813643

IUPACN-butyl-2-(diethylamino)acetamide
SMILESCCCCNC(=O)CN(CC)CC
InChIInChI=1S/C10H22N2O/c1-4-7-8-11-10(13)9-12(5-2)6-3/h4-9H2,1-3H3,(H,11,13)
InChIKeyGEZFSFHNPDZNNV-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.24
Rot. Bonds7

About N-butyl-2-(diethylamino)acetamide

N-butyl-2-(diethylamino)acetamide (PubChem CID 54813643) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-butyl-2-(diethylamino)acetamide.

Molecular Properties

Compound NameN-butyl-2-(diethylamino)acetamide
PubChem CID54813643
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-butyl-2-(diethylamino)acetamide
SMILESCCCCNC(=O)CN(CC)CC
InChIInChI=1S/C10H22N2O/c1-4-7-8-11-10(13)9-12(5-2)6-3/h4-9H2,1-3H3,(H,11,13)
InChIKeyGEZFSFHNPDZNNV-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-butyl-2-(diethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(diethylamino)-N-[3-[[2-(diethylamino)acetyl]amino]propyl]acetamide;dihydrochloride
CID 24832330
N-butyl-2-(dipropylamino)acetamide
CID 54817378
2-(diethylamino)-N-[3-(methylamino)propyl]acetamide
CID 119429887
methyl 3-[[2-(butylamino)-2-oxoethyl]-ethylamino]propanoate
CID 62026967
2-[ethyl(propyl)amino]-N-propylacetamide
CID 135183244
2-(dimethylamino)-N-octadecylacetamide;ethane
CID 90860669
N-decyl-2-[2-[di(nonyl)amino]ethyl-nonylamino]acetamide
CID 137363672
2-[2-[2-[2-[bis[2-(dodecylamino)-2-oxoethyl]amino]ethylamino]ethylamino]ethyl-[2-(dodecylamino)-2-oxoethyl]amino]-N-decylacetamide
CID 118180371
N-butyl-4-[[2-(diethylamino)acetyl]amino]benzamide
CID 54813570
2-[2-[bis(carboxymethyl)amino]ethyl-[2-[carboxymethyl-[2-oxo-2-(tridecylamino)ethyl]amino]ethyl]amino]acetic acid
CID 87241288
N-butyl-N'-pentylpropanediamide
CID 89202031
3-[[2-(butylamino)-2-oxoethyl]-ethylamino]butanoic acid
CID 62826022

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(diethylamino)acetamide?
The IUPAC name of N-butyl-2-(diethylamino)acetamide (CID 54813643) is N-butyl-2-(diethylamino)acetamide.
What is the SMILES notation for N-butyl-2-(diethylamino)acetamide?
The canonical SMILES for N-butyl-2-(diethylamino)acetamide is CCCCNC(=O)CN(CC)CC.
What is the InChIKey of N-butyl-2-(diethylamino)acetamide?
The InChIKey is GEZFSFHNPDZNNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-7-8-11-10(13)9-12(5-2)6-3/h4-9H2,1-3H3,(H,11,13).
What are the key properties of N-butyl-2-(diethylamino)acetamide?
N-butyl-2-(diethylamino)acetamide has a molecular weight of 186.30 g/mol, XLogP of 1.24, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(diethylamino)acetamide is sourced from PubChem (CID 54813643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).