2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline

C23H19N3 — CID 174697832

IUPAC2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline
SMILESc1cc(-c2ncc3ccccc3n2)cc(N2CCCc3ccccc32)c1
InChIInChI=1S/C23H19N3/c1-3-12-21-19(8-1)16-24-23(25-21)18-9-5-11-20(15-18)26-14-6-10-17-7-2-4-13-22(17)26/h1-5,7-9,11-13,15-16H,6,10,14H2
InChIKeyVBUREBZEWAVMGH-UHFFFAOYSA-N
MW337.43 g/mol
LogP5.38
Rot. Bonds2

About 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline

2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline (PubChem CID 174697832) has the molecular formula C23H19N3 and a molecular weight of 337.43 g/mol. Its IUPAC name is 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline.

Molecular Properties

Compound Name2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline
PubChem CID174697832
Molecular FormulaC23H19N3
Molecular Weight337.43 g/mol
Exact Mass337.16
IUPAC Name2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline
SMILESc1cc(-c2ncc3ccccc3n2)cc(N2CCCc3ccccc32)c1
InChIInChI=1S/C23H19N3/c1-3-12-21-19(8-1)16-24-23(25-21)18-9-5-11-20(15-18)26-14-6-10-17-7-2-4-13-22(17)26/h1-5,7-9,11-13,15-16H,6,10,14H2
InChIKeyVBUREBZEWAVMGH-UHFFFAOYSA-N
XLogP5.38
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.43
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethylphenyl)-3,4-dihydro-2H-quinoline
CID 67553271
2-bromo-4-(3,4-dihydro-2H-quinolin-1-yl)benzaldehyde
CID 114060001
ethane;1-phenyl-3,4-dihydro-2H-quinoline
CID 145126037
2-phenylquinazoline
CID 158733567
2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline
CID 140676068
N-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-phenylbenzenesulfinamide
CID 176928082
3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline
CID 174697855
1-[6-(3,4-dihydro-2H-quinolin-1-yl)-9-naphthalen-1-yl-10-(2-naphthalen-1-ylphenyl)anthracen-2-yl]-3,4-dihydro-2H-quinoline
CID 59220392
12,18-diphenyl-15-quinazolin-2-yl-12,18-diaza-1-boraheptacyclo[15.11.1.02,11.04,9.013,29.019,28.021,26]nonacosa-2,4,6,8,10,13,15,17(29),19,21,23,25,27-tridecaene
CID 169072963
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203703
5-quinazolin-2-ylpyrimidin-2-amine
CID 154196702
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109204447

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline?
The IUPAC name of 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline (CID 174697832) is 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline.
What is the SMILES notation for 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline?
The canonical SMILES for 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline is c1cc(-c2ncc3ccccc3n2)cc(N2CCCc3ccccc32)c1.
What is the InChIKey of 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline?
The InChIKey is VBUREBZEWAVMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3/c1-3-12-21-19(8-1)16-24-23(25-21)18-9-5-11-20(15-18)26-14-6-10-17-7-2-4-13-22(17)26/h1-5,7-9,11-13,15-16H,6,10,14H2.
What are the key properties of 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline?
2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline has a molecular weight of 337.43 g/mol, XLogP of 5.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline is sourced from PubChem (CID 174697832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).