2-ethyl-N-(1H-imidazol-2-yl)hexanamide

C11H19N3O — CID 63565385

IUPAC2-ethyl-N-(1H-imidazol-2-yl)hexanamide
SMILESCCCCC(CC)C(=O)Nc1ncc[nH]1
InChIInChI=1S/C11H19N3O/c1-3-5-6-9(4-2)10(15)14-11-12-7-8-13-11/h7-9H,3-6H2,1-2H3,(H2,12,13,14,15)
InChIKeyORARIHFURDNHFJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.56
Rot. Bonds6

About 2-ethyl-N-(1H-imidazol-2-yl)hexanamide

2-ethyl-N-(1H-imidazol-2-yl)hexanamide (PubChem CID 63565385) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-ethyl-N-(1H-imidazol-2-yl)hexanamide.

Molecular Properties

Compound Name2-ethyl-N-(1H-imidazol-2-yl)hexanamide
PubChem CID63565385
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-ethyl-N-(1H-imidazol-2-yl)hexanamide
SMILESCCCCC(CC)C(=O)Nc1ncc[nH]1
InChIInChI=1S/C11H19N3O/c1-3-5-6-9(4-2)10(15)14-11-12-7-8-13-11/h7-9H,3-6H2,1-2H3,(H2,12,13,14,15)
InChIKeyORARIHFURDNHFJ-UHFFFAOYSA-N
XLogP2.56
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1H-imidazol-2-yl)hexanamide?
The IUPAC name of 2-ethyl-N-(1H-imidazol-2-yl)hexanamide (CID 63565385) is 2-ethyl-N-(1H-imidazol-2-yl)hexanamide.
What is the SMILES notation for 2-ethyl-N-(1H-imidazol-2-yl)hexanamide?
The canonical SMILES for 2-ethyl-N-(1H-imidazol-2-yl)hexanamide is CCCCC(CC)C(=O)Nc1ncc[nH]1.
What is the InChIKey of 2-ethyl-N-(1H-imidazol-2-yl)hexanamide?
The InChIKey is ORARIHFURDNHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-5-6-9(4-2)10(15)14-11-12-7-8-13-11/h7-9H,3-6H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 2-ethyl-N-(1H-imidazol-2-yl)hexanamide?
2-ethyl-N-(1H-imidazol-2-yl)hexanamide has a molecular weight of 209.29 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1H-imidazol-2-yl)hexanamide is sourced from PubChem (CID 63565385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).