2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole

C16H18N4 — CID 139469848

IUPAC2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESc1cc2cc(C3NCCN3)ccc2cc1C1=NCCN1
InChIInChI=1S/C16H18N4/c1-3-13(15-17-5-6-18-15)10-12-2-4-14(9-11(1)12)16-19-7-8-20-16/h1-4,9-10,15,17-18H,5-8H2,(H,19,20)
InChIKeyMLZQBZYVGYUVNO-UHFFFAOYSA-N
MW266.35 g/mol
LogP1.38
Rot. Bonds2

About 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole

2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole (PubChem CID 139469848) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole
PubChem CID139469848
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESc1cc2cc(C3NCCN3)ccc2cc1C1=NCCN1
InChIInChI=1S/C16H18N4/c1-3-13(15-17-5-6-18-15)10-12-2-4-14(9-11(1)12)16-19-7-8-20-16/h1-4,9-10,15,17-18H,5-8H2,(H,19,20)
InChIKeyMLZQBZYVGYUVNO-UHFFFAOYSA-N
XLogP1.38
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole (CID 139469848) is 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole is c1cc2cc(C3NCCN3)ccc2cc1C1=NCCN1.
What is the InChIKey of 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The InChIKey is MLZQBZYVGYUVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-3-13(15-17-5-6-18-15)10-12-2-4-14(9-11(1)12)16-19-7-8-20-16/h1-4,9-10,15,17-18H,5-8H2,(H,19,20).
What are the key properties of 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole has a molecular weight of 266.35 g/mol, XLogP of 1.38, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-imidazolidin-2-ylnaphthalen-2-yl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 139469848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).