1-(2-bromonaphthalen-1-yl)acridine

C23H14BrN — CID 175119023

IUPAC1-(2-bromonaphthalen-1-yl)acridine
SMILESBrc1ccc2ccccc2c1-c1cccc2nc3ccccc3cc12
InChIInChI=1S/C23H14BrN/c24-20-13-12-15-6-1-3-8-17(15)23(20)18-9-5-11-22-19(18)14-16-7-2-4-10-21(16)25-22/h1-14H
InChIKeyHINHPQGYPWFCDD-UHFFFAOYSA-N
MW384.28 g/mol
LogP6.97
Rot. Bonds1

About 1-(2-bromonaphthalen-1-yl)acridine

1-(2-bromonaphthalen-1-yl)acridine (PubChem CID 175119023) has the molecular formula C23H14BrN and a molecular weight of 384.28 g/mol. Its IUPAC name is 1-(2-bromonaphthalen-1-yl)acridine.

Molecular Properties

Compound Name1-(2-bromonaphthalen-1-yl)acridine
PubChem CID175119023
Molecular FormulaC23H14BrN
Molecular Weight384.28 g/mol
Exact Mass383.03
IUPAC Name1-(2-bromonaphthalen-1-yl)acridine
SMILESBrc1ccc2ccccc2c1-c1cccc2nc3ccccc3cc12
InChIInChI=1S/C23H14BrN/c24-20-13-12-15-6-1-3-8-17(15)23(20)18-9-5-11-22-19(18)14-16-7-2-4-10-21(16)25-22/h1-14H
InChIKeyHINHPQGYPWFCDD-UHFFFAOYSA-N
XLogP6.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.28
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-bromo-1-naphthalen-1-ylnaphthalene
CID 620109
2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene
CID 139178070
3-(4-acridin-1-yl-3,5-dibromophenyl)propanoic acid
CID 139950916
2-(2-bromonaphthalen-1-yl)phenol
CID 122642120
1-naphthalen-2-ylacridine
CID 91364116
9-[3-(2-bromonaphthalen-1-yl)phenyl]-10-naphthalen-1-ylanthracene
CID 175622318
9-naphthalen-1-ylacridin-3-ol
CID 136705128
1-(1H-pyrazol-5-yl)acridine
CID 141081255
1-naphthalen-1-yl-N,N-diphenylnaphthalen-2-amine
CID 163843201
10-phenyl-5,20-diazaheptacyclo[16.12.0.03,16.04,13.06,11.019,28.021,26]triaconta-1(18),2,4,6,8,10,12,14,16,19,21,23,25,27,29-pentadecaene
CID 141282309
1,10-dinaphthalen-1-ylanthracene
CID 58645117
11-[4-(2,3,4,5-tetraphenylphenyl)phenyl]benzo[a]acridine
CID 164805892

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromonaphthalen-1-yl)acridine?
The IUPAC name of 1-(2-bromonaphthalen-1-yl)acridine (CID 175119023) is 1-(2-bromonaphthalen-1-yl)acridine.
What is the SMILES notation for 1-(2-bromonaphthalen-1-yl)acridine?
The canonical SMILES for 1-(2-bromonaphthalen-1-yl)acridine is Brc1ccc2ccccc2c1-c1cccc2nc3ccccc3cc12.
What is the InChIKey of 1-(2-bromonaphthalen-1-yl)acridine?
The InChIKey is HINHPQGYPWFCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14BrN/c24-20-13-12-15-6-1-3-8-17(15)23(20)18-9-5-11-22-19(18)14-16-7-2-4-10-21(16)25-22/h1-14H.
What are the key properties of 1-(2-bromonaphthalen-1-yl)acridine?
1-(2-bromonaphthalen-1-yl)acridine has a molecular weight of 384.28 g/mol, XLogP of 6.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromonaphthalen-1-yl)acridine is sourced from PubChem (CID 175119023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).