2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole

C14H14N2 — CID 69020024

IUPAC2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole
SMILESC=C1c2ccccc2CCC1c1ncc[nH]1
InChIInChI=1S/C14H14N2/c1-10-12-5-3-2-4-11(12)6-7-13(10)14-15-8-9-16-14/h2-5,8-9,13H,1,6-7H2,(H,15,16)
InChIKeyZQKJKLVTYQXANL-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.15
Rot. Bonds1

About 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole

2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole (PubChem CID 69020024) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole.

Molecular Properties

Compound Name2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole
PubChem CID69020024
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole
SMILESC=C1c2ccccc2CCC1c1ncc[nH]1
InChIInChI=1S/C14H14N2/c1-10-12-5-3-2-4-11(12)6-7-13(10)14-15-8-9-16-14/h2-5,8-9,13H,1,6-7H2,(H,15,16)
InChIKeyZQKJKLVTYQXANL-UHFFFAOYSA-N
XLogP3.15
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole?
The IUPAC name of 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole (CID 69020024) is 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole.
What is the SMILES notation for 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole?
The canonical SMILES for 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole is C=C1c2ccccc2CCC1c1ncc[nH]1.
What is the InChIKey of 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole?
The InChIKey is ZQKJKLVTYQXANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-10-12-5-3-2-4-11(12)6-7-13(10)14-15-8-9-16-14/h2-5,8-9,13H,1,6-7H2,(H,15,16).
What are the key properties of 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole?
2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole has a molecular weight of 210.28 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-imidazole is sourced from PubChem (CID 69020024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).