2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate

C13H16N4O2 — CID 86799221

IUPAC2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OCCn1ccnc1-c1ccccn1
InChIInChI=1S/C13H16N4O2/c1-16(2)13(18)19-10-9-17-8-7-15-12(17)11-5-3-4-6-14-11/h3-8H,9-10H2,1-2H3
InChIKeyVNKRCRYFYUSSLW-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.64
Rot. Bonds4

About 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate

2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate (PubChem CID 86799221) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate.

Molecular Properties

Compound Name2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate
PubChem CID86799221
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OCCn1ccnc1-c1ccccn1
InChIInChI=1S/C13H16N4O2/c1-16(2)13(18)19-10-9-17-8-7-15-12(17)11-5-3-4-6-14-11/h3-8H,9-10H2,1-2H3
InChIKeyVNKRCRYFYUSSLW-UHFFFAOYSA-N
XLogP1.64
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-pyridin-2-ylimidazol-1-yl)acetamide
CID 82558916
N-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]benzamide
CID 86266110
2-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]-1,3-thiazole
CID 169418907
N-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]thiophene-2-carboxamide
CID 86266129
2-(2-methylimidazol-1-yl)ethyl 2-(2-aminophenoxy)acetate
CID 61493883
2-[1-[2-(furan-2-yl)ethyl]imidazol-2-yl]pyridine
CID 169417860
2-[1-[[4-[(2-pyridin-2-ylimidazol-1-yl)methyl]phenyl]methyl]imidazol-2-yl]pyridine;dihydrate
CID 139073564
2-(5,6-dimethylbenzimidazol-1-yl)ethyl N,N-dimethylcarbamate
CID 91661402
1-phenyl-N-[2-(2-pyridin-2-ylimidazol-1-yl)ethyl]methanesulfonamide
CID 86266163
N-methyl-2-[2-(4-pyridin-2-ylphenyl)imidazol-1-yl]acetamide
CID 82559650
dichloroosmium;bis(2-(1-methylimidazol-2-yl)pyridine)
CID 23534671
1-(3,5-dimethylphenyl)-2-(2-pyridin-2-ylimidazol-1-yl)ethanol
CID 109411368

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate?
The IUPAC name of 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate (CID 86799221) is 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate.
What is the SMILES notation for 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate?
The canonical SMILES for 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate is CN(C)C(=O)OCCn1ccnc1-c1ccccn1.
What is the InChIKey of 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate?
The InChIKey is VNKRCRYFYUSSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-16(2)13(18)19-10-9-17-8-7-15-12(17)11-5-3-4-6-14-11/h3-8H,9-10H2,1-2H3.
What are the key properties of 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate?
2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate has a molecular weight of 260.30 g/mol, XLogP of 1.64, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-2-ylimidazol-1-yl)ethyl N,N-dimethylcarbamate is sourced from PubChem (CID 86799221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).