4-naphthalen-2-ylquinazoline

C18H12N2 — CID 58881337

IUPAC4-naphthalen-2-ylquinazoline
SMILESc1ccc2cc(-c3ncnc4ccccc34)ccc2c1
InChIInChI=1S/C18H12N2/c1-2-6-14-11-15(10-9-13(14)5-1)18-16-7-3-4-8-17(16)19-12-20-18/h1-12H
InChIKeyJTDWHFCZRTXFFZ-UHFFFAOYSA-N
MW256.31 g/mol
LogP4.45
Rot. Bonds1

About 4-naphthalen-2-ylquinazoline

4-naphthalen-2-ylquinazoline (PubChem CID 58881337) has the molecular formula C18H12N2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-naphthalen-2-ylquinazoline.

Molecular Properties

Compound Name4-naphthalen-2-ylquinazoline
PubChem CID58881337
Molecular FormulaC18H12N2
Molecular Weight256.31 g/mol
Exact Mass256.10
IUPAC Name4-naphthalen-2-ylquinazoline
SMILESc1ccc2cc(-c3ncnc4ccccc34)ccc2c1
InChIInChI=1S/C18H12N2/c1-2-6-14-11-15(10-9-13(14)5-1)18-16-7-3-4-8-17(16)19-12-20-18/h1-12H
InChIKeyJTDWHFCZRTXFFZ-UHFFFAOYSA-N
XLogP4.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-naphthalen-2-ylquinoline
CID 14173372
4-naphthalen-2-yl-2-propan-2-ylquinazoline
CID 130266064
4-[4-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)phenyl]quinazoline
CID 164799829
4-naphthalen-2-yloxyquinazoline
CID 31538161
7-naphthalen-1-yl-4-(4-phenylphenyl)quinazoline
CID 159038864
1-naphthalen-2-ylacridine
CID 91364116
N-naphthalen-2-ylquinazolin-4-amine
CID 110434772
N-propan-2-yl-4-quinazolin-4-ylaniline
CID 141220495
2-chloro-4-naphthalen-2-ylquinoline
CID 118874947
6-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthridine
CID 58323745
7,12-bis(6-naphthalen-2-ylnaphthalen-2-yl)benzo[j]phenanthridine
CID 59183805
1-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]isoquinoline
CID 122426440

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-ylquinazoline?
The IUPAC name of 4-naphthalen-2-ylquinazoline (CID 58881337) is 4-naphthalen-2-ylquinazoline.
What is the SMILES notation for 4-naphthalen-2-ylquinazoline?
The canonical SMILES for 4-naphthalen-2-ylquinazoline is c1ccc2cc(-c3ncnc4ccccc34)ccc2c1.
What is the InChIKey of 4-naphthalen-2-ylquinazoline?
The InChIKey is JTDWHFCZRTXFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2/c1-2-6-14-11-15(10-9-13(14)5-1)18-16-7-3-4-8-17(16)19-12-20-18/h1-12H.
What are the key properties of 4-naphthalen-2-ylquinazoline?
4-naphthalen-2-ylquinazoline has a molecular weight of 256.31 g/mol, XLogP of 4.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-ylquinazoline is sourced from PubChem (CID 58881337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).