N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide

C12H22N4O3 — CID 106720510

IUPACN-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide
SMILESCOCCNCc1cn(CC(=O)NCCOC)cn1
InChIInChI=1S/C12H22N4O3/c1-18-5-3-13-7-11-8-16(10-15-11)9-12(17)14-4-6-19-2/h8,10,13H,3-7,9H2,1-2H3,(H,14,17)
InChIKeyZSNWUAPRRLYTIO-UHFFFAOYSA-N
MW270.33 g/mol
LogP-0.62
Rot. Bonds10

About N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide

N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide (PubChem CID 106720510) has the molecular formula C12H22N4O3 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide
PubChem CID106720510
Molecular FormulaC12H22N4O3
Molecular Weight270.33 g/mol
Exact Mass270.17
IUPAC NameN-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide
SMILESCOCCNCc1cn(CC(=O)NCCOC)cn1
InChIInChI=1S/C12H22N4O3/c1-18-5-3-13-7-11-8-16(10-15-11)9-12(17)14-4-6-19-2/h8,10,13H,3-7,9H2,1-2H3,(H,14,17)
InChIKeyZSNWUAPRRLYTIO-UHFFFAOYSA-N
XLogP-0.62
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]-N-(3-methoxypropyl)acetamide
CID 106720364
N-cyclopropyl-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]-N-methylacetamide
CID 106720377
methyl 4-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]butanoate
CID 106720528
methyl 2-[4-(propylaminomethyl)imidazol-1-yl]acetate
CID 106719124
2-methoxy-N-[[1-(3-methylbutyl)imidazol-4-yl]methyl]ethanamine
CID 106720362
N-[[1-(3-ethylsulfonylpropyl)imidazol-4-yl]methyl]-2-methoxyethanamine
CID 106720370
N-[[1-(2-methoxyethyl)imidazol-4-yl]methyl]propan-1-amine
CID 106719021
N-(3-methylbutyl)-2-[4-[(propan-2-ylamino)methyl]imidazol-1-yl]acetamide
CID 106719405
2-methoxy-N-[[1-[(4-methoxyphenyl)methyl]imidazol-4-yl]methyl]ethanamine
CID 106720459
2-methoxy-N-[[1-(3-propoxypropyl)imidazol-4-yl]methyl]ethanamine
CID 114204437
4-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]butanenitrile
CID 106720634
N-butyl-2-[4-[(propan-2-ylamino)methyl]imidazol-1-yl]acetamide
CID 106719404

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide (CID 106720510) is N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide is COCCNCc1cn(CC(=O)NCCOC)cn1.
What is the InChIKey of N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide?
The InChIKey is ZSNWUAPRRLYTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O3/c1-18-5-3-13-7-11-8-16(10-15-11)9-12(17)14-4-6-19-2/h8,10,13H,3-7,9H2,1-2H3,(H,14,17).
What are the key properties of N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide?
N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide has a molecular weight of 270.33 g/mol, XLogP of -0.62, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[4-[(2-methoxyethylamino)methyl]imidazol-1-yl]acetamide is sourced from PubChem (CID 106720510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).