5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole

C15H20N2 — CID 10728068

IUPAC5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1cc2c(cc1C)CC(CC1CN=CN1)C2
InChIInChI=1S/C15H20N2/c1-10-3-13-5-12(6-14(13)4-11(10)2)7-15-8-16-9-17-15/h3-4,9,12,15H,5-8H2,1-2H3,(H,16,17)
InChIKeyMOZAMAQLWQBIOW-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.41
Rot. Bonds2

About 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole

5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole (PubChem CID 10728068) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole
PubChem CID10728068
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1cc2c(cc1C)CC(CC1CN=CN1)C2
InChIInChI=1S/C15H20N2/c1-10-3-13-5-12(6-14(13)4-11(10)2)7-15-8-16-9-17-15/h3-4,9,12,15H,5-8H2,1-2H3,(H,16,17)
InChIKeyMOZAMAQLWQBIOW-UHFFFAOYSA-N
XLogP2.41
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole (CID 10728068) is 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole is Cc1cc2c(cc1C)CC(CC1CN=CN1)C2.
What is the InChIKey of 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The InChIKey is MOZAMAQLWQBIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10-3-13-5-12(6-14(13)4-11(10)2)7-15-8-16-9-17-15/h3-4,9,12,15H,5-8H2,1-2H3,(H,16,17).
What are the key properties of 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole?
5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole has a molecular weight of 228.34 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5,6-dimethyl-2,3-dihydro-1H-inden-2-yl)methyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10728068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).