N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide

C10H18N4O — CID 104923403

IUPACN-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide
SMILESCCN(C)C(=O)CNCc1cncn1C
InChIInChI=1S/C10H18N4O/c1-4-13(2)10(15)7-11-5-9-6-12-8-14(9)3/h6,8,11H,4-5,7H2,1-3H3
InChIKeyXBWGGGITGPBDDE-UHFFFAOYSA-N
MW210.28 g/mol
LogP-0.01
Rot. Bonds5

About N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide

N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide (PubChem CID 104923403) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide
PubChem CID104923403
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide
SMILESCCN(C)C(=O)CNCc1cncn1C
InChIInChI=1S/C10H18N4O/c1-4-13(2)10(15)7-11-5-9-6-12-8-14(9)3/h6,8,11H,4-5,7H2,1-3H3
InChIKeyXBWGGGITGPBDDE-UHFFFAOYSA-N
XLogP-0.01
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-methylimidazol-4-yl)methylamino]-N-propan-2-ylacetamide
CID 62999572
N-ethyl-N-methyl-2-[(1-propylpyrrol-2-yl)methylamino]acetamide
CID 107640510
N-ethyl-N-methyl-2-[(3-methyl-4-pyridinyl)methylamino]acetamide
CID 114699647
N,N-dimethyl-2-[(3-methylimidazol-4-yl)methylamino]propanamide
CID 63002220
N-ethyl-N'-[(3-methylimidazol-4-yl)methyl]propane-1,3-diamine
CID 103510883
N'-[(3-methylimidazol-4-yl)methyl]-N-propylpropane-1,3-diamine
CID 103510884
2-[(5-bromo-2-pyridinyl)methylamino]-N-ethyl-N-methylacetamide
CID 104923461
2-ethylsulfinyl-N-[(3-methylimidazol-4-yl)methyl]ethanamine
CID 115632286
2-ethoxy-2-methyl-N-[(3-methylimidazol-4-yl)methyl]propan-1-amine
CID 114940693
(2S)-2-[(3-methylimidazol-4-yl)methylamino]propanoic acid
CID 83193799
2-[(3,4-dichlorophenyl)methylamino]-N-ethyl-N-methylacetamide
CID 104923577
1-(3-methylimidazol-4-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 63001488

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide?
The IUPAC name of N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide (CID 104923403) is N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide is CCN(C)C(=O)CNCc1cncn1C.
What is the InChIKey of N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide?
The InChIKey is XBWGGGITGPBDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-13(2)10(15)7-11-5-9-6-12-8-14(9)3/h6,8,11H,4-5,7H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide?
N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide has a molecular weight of 210.28 g/mol, XLogP of -0.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[(3-methylimidazol-4-yl)methylamino]acetamide is sourced from PubChem (CID 104923403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).