2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide

C11H22N4O — CID 57165918

IUPAC2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide
SMILESCCN(CC)CC(=O)NCN1C=CN(C)C1
InChIInChI=1S/C11H22N4O/c1-4-14(5-2)8-11(16)12-9-15-7-6-13(3)10-15/h6-7H,4-5,8-10H2,1-3H3,(H,12,16)
InChIKeyNRNBQQGEWXQNJJ-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.08
Rot. Bonds6

About 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide

2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide (PubChem CID 57165918) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide
PubChem CID57165918
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC Name2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide
SMILESCCN(CC)CC(=O)NCN1C=CN(C)C1
InChIInChI=1S/C11H22N4O/c1-4-14(5-2)8-11(16)12-9-15-7-6-13(3)10-15/h6-7H,4-5,8-10H2,1-3H3,(H,12,16)
InChIKeyNRNBQQGEWXQNJJ-UHFFFAOYSA-N
XLogP0.08
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)-N-[(3-prop-2-enyl-2H-imidazol-1-yl)methyl]acetamide
CID 57084211
N-butyl-N-methyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 67523463
N,N-diethyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 67523534
N-butyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 69670276
N-[1-acetamido-2-[acetyl(ethenyl)amino]ethyl]acetamide
CID 87622573
N,1,3-trimethyl-2H-imidazole-2-carboxamide
CID 138514062
Ethane;1-ethyl-2-methylideneimidazolidin-4-one
CID 141786324
1-ethyl-3-methyl-2H-imidazol-1-ium-1,2-dicarboxamide
CID 159557479
N-butyl-2-(3-methyl-2H-imidazol-1-yl)acetamide;hydrobromide
CID 173199786
3-(2-oxo-1H-imidazol-3-yl)piperazin-2-one
CID 173421814
2-(3-butyl-2H-imidazol-1-yl)acetamide;cyanocyanamide
CID 175037818
3-butyl-1-methyl-2H-imidazol-1-ium-1,2-dicarboxamide
CID 175870516

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide?
The IUPAC name of 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide (CID 57165918) is 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide.
What is the SMILES notation for 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide?
The canonical SMILES for 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide is CCN(CC)CC(=O)NCN1C=CN(C)C1.
What is the InChIKey of 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide?
The InChIKey is NRNBQQGEWXQNJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-4-14(5-2)8-11(16)12-9-15-7-6-13(3)10-15/h6-7H,4-5,8-10H2,1-3H3,(H,12,16).
What are the key properties of 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide?
2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide is sourced from PubChem (CID 57165918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).