N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide

C15H20N4O — CID 62223549

IUPACN-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide
SMILESCCNCc1nccn1CC(=O)NCc1ccccc1
InChIInChI=1S/C15H20N4O/c1-2-16-11-14-17-8-9-19(14)12-15(20)18-10-13-6-4-3-5-7-13/h3-9,16H,2,10-12H2,1H3,(H,18,20)
InChIKeyJHBOLNWQCROWEE-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.31
Rot. Bonds7

About N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide

N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide (PubChem CID 62223549) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide
PubChem CID62223549
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide
SMILESCCNCc1nccn1CC(=O)NCc1ccccc1
InChIInChI=1S/C15H20N4O/c1-2-16-11-14-17-8-9-19(14)12-15(20)18-10-13-6-4-3-5-7-13/h3-9,16H,2,10-12H2,1H3,(H,18,20)
InChIKeyJHBOLNWQCROWEE-UHFFFAOYSA-N
XLogP1.31
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-[2-[(cyclopropylamino)methyl]imidazol-1-yl]acetamide
CID 62223579
N-benzyl-2-[2-(ethylaminomethyl)pyrrol-1-yl]acetamide
CID 66402920
N-[(1-benzylimidazol-2-yl)methyl]ethanamine;hydrochloride
CID 45156296
N-propyl-2-[2-(propylaminomethyl)imidazol-1-yl]acetamide
CID 55048710
methyl 2-[2-(ethylaminomethyl)imidazol-1-yl]acetate
CID 62221436
N-(4-bromophenyl)-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide
CID 62223377
2-[2-(ethylaminomethyl)imidazol-1-yl]-N-(4-fluorophenyl)acetamide
CID 62223733
N-[(1-benzylimidazol-2-yl)methyl]-3-hydroxy-3-phenylbutanamide
CID 110025568
N-benzyl-2-[4-[2-(2-methylimidazol-1-yl)ethyl]piperazin-1-yl]acetamide
CID 90533919
N-[[1-(2-phenylethyl)imidazol-2-yl]methyl]-2-pyrrolidin-1-ylacetamide
CID 166249976
2-(cyclopropylmethylamino)-N-[[1-(2-phenylethyl)imidazol-2-yl]methyl]acetamide;dihydrochloride
CID 119898678
N-(2-bromophenyl)-2-[2-(propylaminomethyl)imidazol-1-yl]acetamide
CID 62223923

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide?
The IUPAC name of N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide (CID 62223549) is N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide.
What is the SMILES notation for N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide?
The canonical SMILES for N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide is CCNCc1nccn1CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide?
The InChIKey is JHBOLNWQCROWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-16-11-14-17-8-9-19(14)12-15(20)18-10-13-6-4-3-5-7-13/h3-9,16H,2,10-12H2,1H3,(H,18,20).
What are the key properties of N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide?
N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide is sourced from PubChem (CID 62223549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).