N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide

C11H12N4O — CID 64529840

IUPACN-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NCc1ncc[nH]1
InChIInChI=1S/C11H12N4O/c16-11(7-9-3-1-2-4-12-9)15-8-10-13-5-6-14-10/h1-6H,7-8H2,(H,13,14)(H,15,16)
InChIKeyXEHCCIRJRFGKMD-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.66
Rot. Bonds4

About N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide

N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide (PubChem CID 64529840) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide
PubChem CID64529840
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NCc1ncc[nH]1
InChIInChI=1S/C11H12N4O/c16-11(7-9-3-1-2-4-12-9)15-8-10-13-5-6-14-10/h1-6H,7-8H2,(H,13,14)(H,15,16)
InChIKeyXEHCCIRJRFGKMD-UHFFFAOYSA-N
XLogP0.66
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)phenyl]-N-(1H-imidazol-2-ylmethyl)acetamide
CID 81321885
2-[2-(1H-imidazol-2-ylmethylamino)-2-oxoethyl]benzoic acid
CID 104601596
2-(4-aminophenyl)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64517782
N-(1H-imidazol-2-ylmethyl)-2-(1H-pyrazol-5-yl)acetamide
CID 79139019
N-[(3-phenyl-1H-1,2,4-triazol-5-yl)methyl]-2-pyridin-2-ylacetamide
CID 77083716
N-(3-hydroxy-2-methylpropyl)-2-pyridin-2-ylacetamide
CID 65037494
2-acetamido-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64531448
N-[[4-(4-methylphenyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-2-pyridin-2-ylacetamide
CID 56740363
2-(ethylamino)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64529772
ethyl 2-[(2-pyridin-2-ylacetyl)amino]acetate
CID 55026375
2-(2-aminophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 113315085
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64532408

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide (CID 64529840) is N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide is O=C(Cc1ccccn1)NCc1ncc[nH]1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide?
The InChIKey is XEHCCIRJRFGKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c16-11(7-9-3-1-2-4-12-9)15-8-10-13-5-6-14-10/h1-6H,7-8H2,(H,13,14)(H,15,16).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide?
N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide has a molecular weight of 216.24 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-2-pyridin-2-ylacetamide is sourced from PubChem (CID 64529840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).