1-(1H-inden-2-yl)imidazole

C12H10N2 — CID 6540058

IUPAC1-(1H-inden-2-yl)imidazole
SMILESC1=C(n2ccnc2)Cc2ccccc21
InChIInChI=1S/C12H10N2/c1-2-4-11-8-12(7-10(11)3-1)14-6-5-13-9-14/h1-7,9H,8H2
InChIKeyVIJOGXCGVQRAPW-UHFFFAOYSA-N
MW182.23 g/mol
LogP2.44
Rot. Bonds1

About 1-(1H-inden-2-yl)imidazole

1-(1H-inden-2-yl)imidazole (PubChem CID 6540058) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 1-(1H-inden-2-yl)imidazole.

Molecular Properties

Compound Name1-(1H-inden-2-yl)imidazole
PubChem CID6540058
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name1-(1H-inden-2-yl)imidazole
SMILESC1=C(n2ccnc2)Cc2ccccc21
InChIInChI=1S/C12H10N2/c1-2-4-11-8-12(7-10(11)3-1)14-6-5-13-9-14/h1-7,9H,8H2
InChIKeyVIJOGXCGVQRAPW-UHFFFAOYSA-N
XLogP2.44
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-inden-2-yl)imidazole?
The IUPAC name of 1-(1H-inden-2-yl)imidazole (CID 6540058) is 1-(1H-inden-2-yl)imidazole.
What is the SMILES notation for 1-(1H-inden-2-yl)imidazole?
The canonical SMILES for 1-(1H-inden-2-yl)imidazole is C1=C(n2ccnc2)Cc2ccccc21.
What is the InChIKey of 1-(1H-inden-2-yl)imidazole?
The InChIKey is VIJOGXCGVQRAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2/c1-2-4-11-8-12(7-10(11)3-1)14-6-5-13-9-14/h1-7,9H,8H2.
What are the key properties of 1-(1H-inden-2-yl)imidazole?
1-(1H-inden-2-yl)imidazole has a molecular weight of 182.23 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-inden-2-yl)imidazole is sourced from PubChem (CID 6540058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).