cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone

C11H11N3O — CID 174594199

IUPACcyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone
SMILESO=C(C1CC1)n1cccc1-c1ncc[nH]1
InChIInChI=1S/C11H11N3O/c15-11(8-3-4-8)14-7-1-2-9(14)10-12-5-6-13-10/h1-2,5-8H,3-4H2,(H,12,13)
InChIKeyYZYQFOUWWNLMIA-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.93
Rot. Bonds2

About cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone

cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone (PubChem CID 174594199) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone
PubChem CID174594199
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Namecyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone
SMILESO=C(C1CC1)n1cccc1-c1ncc[nH]1
InChIInChI=1S/C11H11N3O/c15-11(8-3-4-8)14-7-1-2-9(14)10-12-5-6-13-10/h1-2,5-8H,3-4H2,(H,12,13)
InChIKeyYZYQFOUWWNLMIA-UHFFFAOYSA-N
XLogP1.93
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone?
The IUPAC name of cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone (CID 174594199) is cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone?
The canonical SMILES for cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone is O=C(C1CC1)n1cccc1-c1ncc[nH]1.
What is the InChIKey of cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone?
The InChIKey is YZYQFOUWWNLMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c15-11(8-3-4-8)14-7-1-2-9(14)10-12-5-6-13-10/h1-2,5-8H,3-4H2,(H,12,13).
What are the key properties of cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone?
cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone has a molecular weight of 201.23 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[2-(1H-imidazol-2-yl)pyrrol-1-yl]methanone is sourced from PubChem (CID 174594199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).