N-(diethylaminomethyl)-N-ethylacetamide

C9H20N2O — CID 134878338

IUPACN-(diethylaminomethyl)-N-ethylacetamide
SMILESCCN(CC)CN(CC)C(C)=O
InChIInChI=1S/C9H20N2O/c1-5-10(6-2)8-11(7-3)9(4)12/h5-8H2,1-4H3
InChIKeyOIYXCIFYYOTDND-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.15
Rot. Bonds5

About N-(diethylaminomethyl)-N-ethylacetamide

N-(diethylaminomethyl)-N-ethylacetamide (PubChem CID 134878338) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N-(diethylaminomethyl)-N-ethylacetamide.

Molecular Properties

Compound NameN-(diethylaminomethyl)-N-ethylacetamide
PubChem CID134878338
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN-(diethylaminomethyl)-N-ethylacetamide
SMILESCCN(CC)CN(CC)C(C)=O
InChIInChI=1S/C9H20N2O/c1-5-10(6-2)8-11(7-3)9(4)12/h5-8H2,1-4H3
InChIKeyOIYXCIFYYOTDND-UHFFFAOYSA-N
XLogP1.15
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Tetraethylurea
CID 14465
N,N-Diethyl-N',N'-dimethylurea
CID 13484278
N-[(dimethylamino)methyl]-N-methylacetamide
CID 12719367
1-(2,3-Dimethyltetrahydropyrimidin-1(2H)-yl)ethanone
CID 45086048
N-(diethylaminomethyl)-N-ethylformamide
CID 134895068
N-(diethylcarbamoyl)-2-(dimethylamino)-N-ethylacetamide
CID 285571
N-acetyl-N-[1-(dimethylamino)propyl]acetamide
CID 17775519
1,1,3-Triethyl-3-methylurea
CID 19962441
[[2-[Acetyl(methyl)amino]acetyl]-methylamino]methyl-trimethylazanium
CID 20652486
2-[acetyl(methyl)amino]-N-[(dimethylamino)methyl]-N-methylacetamide
CID 20652487
dimethylaminomethanone;N-[1-[ethyl(methyl)amino]ethyl]-N-methylacetamide;tungsten(2+)
CID 20685239
N-methyl-N-[[methyl(propan-2-yl)amino]methyl]acetamide
CID 21336479

Frequently Asked Questions

What is the IUPAC name of N-(diethylaminomethyl)-N-ethylacetamide?
The IUPAC name of N-(diethylaminomethyl)-N-ethylacetamide (CID 134878338) is N-(diethylaminomethyl)-N-ethylacetamide.
What is the SMILES notation for N-(diethylaminomethyl)-N-ethylacetamide?
The canonical SMILES for N-(diethylaminomethyl)-N-ethylacetamide is CCN(CC)CN(CC)C(C)=O.
What is the InChIKey of N-(diethylaminomethyl)-N-ethylacetamide?
The InChIKey is OIYXCIFYYOTDND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-10(6-2)8-11(7-3)9(4)12/h5-8H2,1-4H3.
What are the key properties of N-(diethylaminomethyl)-N-ethylacetamide?
N-(diethylaminomethyl)-N-ethylacetamide has a molecular weight of 172.27 g/mol, XLogP of 1.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diethylaminomethyl)-N-ethylacetamide is sourced from PubChem (CID 134878338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).