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

C14H16N2 — CID 10176715

IUPAC5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole
SMILESC1=NCC(CC2=Cc3ccccc3CC2)N1
InChIInChI=1S/C14H16N2/c1-2-4-13-7-11(5-6-12(13)3-1)8-14-9-15-10-16-14/h1-4,7,10,14H,5-6,8-9H2,(H,15,16)
InChIKeyWNPGIHKSPQIODH-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.41
Rot. Bonds2

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

5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole (PubChem CID 10176715) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole
PubChem CID10176715
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole
SMILESC1=NCC(CC2=Cc3ccccc3CC2)N1
InChIInChI=1S/C14H16N2/c1-2-4-13-7-11(5-6-12(13)3-1)8-14-9-15-10-16-14/h1-4,7,10,14H,5-6,8-9H2,(H,15,16)
InChIKeyWNPGIHKSPQIODH-UHFFFAOYSA-N
XLogP2.41
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole (CID 10176715) is 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole is C1=NCC(CC2=Cc3ccccc3CC2)N1.
What is the InChIKey of 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole?
The InChIKey is WNPGIHKSPQIODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-4-13-7-11(5-6-12(13)3-1)8-14-9-15-10-16-14/h1-4,7,10,14H,5-6,8-9H2,(H,15,16).
What are the key properties of 5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole?
5-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole has a molecular weight of 212.30 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-(3,4-dihydronaphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10176715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).