5-ethyl-1-methylimidazole-2-carboxamide

C7H11N3O — CID 89348260

IUPAC5-ethyl-1-methylimidazole-2-carboxamide
SMILESCCc1cnc(C(N)=O)n1C
InChIInChI=1S/C7H11N3O/c1-3-5-4-9-7(6(8)11)10(5)2/h4H,3H2,1-2H3,(H2,8,11)
InChIKeyUKRDNEHTPHZMDG-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.08
Rot. Bonds2

About 5-ethyl-1-methylimidazole-2-carboxamide

5-ethyl-1-methylimidazole-2-carboxamide (PubChem CID 89348260) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 5-ethyl-1-methylimidazole-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-1-methylimidazole-2-carboxamide
PubChem CID89348260
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name5-ethyl-1-methylimidazole-2-carboxamide
SMILESCCc1cnc(C(N)=O)n1C
InChIInChI=1S/C7H11N3O/c1-3-5-4-9-7(6(8)11)10(5)2/h4H,3H2,1-2H3,(H2,8,11)
InChIKeyUKRDNEHTPHZMDG-UHFFFAOYSA-N
XLogP0.08
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-methylimidazole-2-carboxamide?
The IUPAC name of 5-ethyl-1-methylimidazole-2-carboxamide (CID 89348260) is 5-ethyl-1-methylimidazole-2-carboxamide.
What is the SMILES notation for 5-ethyl-1-methylimidazole-2-carboxamide?
The canonical SMILES for 5-ethyl-1-methylimidazole-2-carboxamide is CCc1cnc(C(N)=O)n1C.
What is the InChIKey of 5-ethyl-1-methylimidazole-2-carboxamide?
The InChIKey is UKRDNEHTPHZMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-5-4-9-7(6(8)11)10(5)2/h4H,3H2,1-2H3,(H2,8,11).
What are the key properties of 5-ethyl-1-methylimidazole-2-carboxamide?
5-ethyl-1-methylimidazole-2-carboxamide has a molecular weight of 153.18 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-methylimidazole-2-carboxamide is sourced from PubChem (CID 89348260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).