2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole

C13H14N2 — CID 14456173

IUPAC2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESC1=C(C2=NCCN2)CCc2ccccc21
InChIInChI=1S/C13H14N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-4,9H,5-8H2,(H,14,15)
InChIKeySXZUZNSWIBDKGQ-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.02
Rot. Bonds1

About 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole

2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole (PubChem CID 14456173) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
PubChem CID14456173
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESC1=C(C2=NCCN2)CCc2ccccc21
InChIInChI=1S/C13H14N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-4,9H,5-8H2,(H,14,15)
InChIKeySXZUZNSWIBDKGQ-UHFFFAOYSA-N
XLogP2.02
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 5419
Naphazoline Hydrochloride
CID 11079
Naphazoline
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Tolazoline
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Tolazoline Hydrochloride
CID 6048
Tetrahydrozoline Hydrochloride
CID 10648
Cibenzoline
CID 2747
2-Phenylimidazoline
CID 13639
Phenyzoline
CID 33273
Benazoline
CID 11769428
Beta-naphazoline
CID 610682
Tracizoline
CID 6455104

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole (CID 14456173) is 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole is C1=C(C2=NCCN2)CCc2ccccc21.
What is the InChIKey of 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The InChIKey is SXZUZNSWIBDKGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-4,9H,5-8H2,(H,14,15).
What are the key properties of 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole has a molecular weight of 198.27 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 14456173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).