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

C15H18N2 — CID 10609307

IUPAC5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc2c(c1)CCC(CC1CN=CN1)=C2
InChIInChI=1S/C15H18N2/c1-11-2-4-14-7-12(3-5-13(14)6-11)8-15-9-16-10-17-15/h2,4,6-7,10,15H,3,5,8-9H2,1H3,(H,16,17)
InChIKeyXDZBVZMDNGYWTG-UHFFFAOYSA-N
MW226.32 g/mol
LogP2.71
Rot. Bonds2

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

5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole (PubChem CID 10609307) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole
PubChem CID10609307
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc2c(c1)CCC(CC1CN=CN1)=C2
InChIInChI=1S/C15H18N2/c1-11-2-4-14-7-12(3-5-13(14)6-11)8-15-9-16-10-17-15/h2,4,6-7,10,15H,3,5,8-9H2,1H3,(H,16,17)
InChIKeyXDZBVZMDNGYWTG-UHFFFAOYSA-N
XLogP2.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole (CID 10609307) is 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole is Cc1ccc2c(c1)CCC(CC1CN=CN1)=C2.
What is the InChIKey of 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole?
The InChIKey is XDZBVZMDNGYWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-11-2-4-14-7-12(3-5-13(14)6-11)8-15-9-16-10-17-15/h2,4,6-7,10,15H,3,5,8-9H2,1H3,(H,16,17).
What are the key properties of 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole?
5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole has a molecular weight of 226.32 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-methyl-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10609307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).