2-ethoxy-N-(1H-imidazol-2-yl)benzamide

C12H13N3O2 — CID 60967218

IUPAC2-ethoxy-N-(1H-imidazol-2-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ncc[nH]1
InChIInChI=1S/C12H13N3O2/c1-2-17-10-6-4-3-5-9(10)11(16)15-12-13-7-8-14-12/h3-8H,2H2,1H3,(H2,13,14,15,16)
InChIKeyCRSWPSWNQXAJAV-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.06
Rot. Bonds4

About 2-ethoxy-N-(1H-imidazol-2-yl)benzamide

2-ethoxy-N-(1H-imidazol-2-yl)benzamide (PubChem CID 60967218) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 2-ethoxy-N-(1H-imidazol-2-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(1H-imidazol-2-yl)benzamide
PubChem CID60967218
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name2-ethoxy-N-(1H-imidazol-2-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ncc[nH]1
InChIInChI=1S/C12H13N3O2/c1-2-17-10-6-4-3-5-9(10)11(16)15-12-13-7-8-14-12/h3-8H,2H2,1H3,(H2,13,14,15,16)
InChIKeyCRSWPSWNQXAJAV-UHFFFAOYSA-N
XLogP2.06
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-imidazol-2-yl)-2-methylbenzamide
CID 60968635
N-(1H-imidazol-2-yl)-2-(methylamino)benzamide
CID 63563761
N-(1H-imidazol-2-yl)-2,3-dimethoxybenzamide
CID 55027603
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
(2-ethoxyphenyl)-(1H-imidazol-2-yl)methanone
CID 112731515
2-hydroxy-N-(1H-imidazol-2-yl)-3-methylbenzamide
CID 60968361
2-[(2-ethoxybenzoyl)amino]-N-pyridin-2-ylbenzamide
CID 90010791
N-(2-bromo-3-pyridinyl)-2-ethoxybenzamide
CID 103819498
2-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 836714
ethane;2-ethoxy-N-methylbenzamide
CID 142472808
N-(4-chloro-2-pyridinyl)-2-ethoxybenzamide
CID 113236114
1-(2-ethoxyphenyl)-2-(1H-imidazol-2-ylsulfanyl)ethanone
CID 107781155

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1H-imidazol-2-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(1H-imidazol-2-yl)benzamide (CID 60967218) is 2-ethoxy-N-(1H-imidazol-2-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(1H-imidazol-2-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(1H-imidazol-2-yl)benzamide is CCOc1ccccc1C(=O)Nc1ncc[nH]1.
What is the InChIKey of 2-ethoxy-N-(1H-imidazol-2-yl)benzamide?
The InChIKey is CRSWPSWNQXAJAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-2-17-10-6-4-3-5-9(10)11(16)15-12-13-7-8-14-12/h3-8H,2H2,1H3,(H2,13,14,15,16).
What are the key properties of 2-ethoxy-N-(1H-imidazol-2-yl)benzamide?
2-ethoxy-N-(1H-imidazol-2-yl)benzamide has a molecular weight of 231.25 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1H-imidazol-2-yl)benzamide is sourced from PubChem (CID 60967218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).