3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline

C22H18N2O — CID 174697855

IUPAC3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline
SMILESc1coc(-c2nc3ccccc3cc2N2CCCc3ccccc32)c1
InChIInChI=1S/C22H18N2O/c1-3-10-18-17(8-1)15-20(22(23-18)21-12-6-14-25-21)24-13-5-9-16-7-2-4-11-19(16)24/h1-4,6-8,10-12,14-15H,5,9,13H2
InChIKeyZWLDAJJBGDJKMS-UHFFFAOYSA-N
MW326.40 g/mol
LogP5.58
Rot. Bonds2

About 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline

3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline (PubChem CID 174697855) has the molecular formula C22H18N2O and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline
PubChem CID174697855
Molecular FormulaC22H18N2O
Molecular Weight326.40 g/mol
Exact Mass326.14
IUPAC Name3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline
SMILESc1coc(-c2nc3ccccc3cc2N2CCCc3ccccc32)c1
InChIInChI=1S/C22H18N2O/c1-3-10-18-17(8-1)15-20(22(23-18)21-12-6-14-25-21)24-13-5-9-16-7-2-4-11-19(16)24/h1-4,6-8,10-12,14-15H,5,9,13H2
InChIKeyZWLDAJJBGDJKMS-UHFFFAOYSA-N
XLogP5.58
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.40
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

fluorobenzene;3-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline
CID 174697852
[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 2,3-bis(furan-2-yl)quinoxaline-6-carboxylate
CID 23802826
[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxobutan-2-yl] 2,3-bis(furan-2-yl)quinoxaline-6-carboxylate
CID 23860348
3-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(1H-indazol-5-yl)quinoline
CID 150226086
2-[3-(3,4-dihydro-2H-quinolin-1-yl)phenyl]quinazoline
CID 174697832
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[2-(furan-2-yl)benzimidazol-1-yl]ethanone
CID 1176479
3-(furan-2-yl)quinoxalin-2-amine
CID 102364345
2-(3,4-dihydro-2H-quinolin-1-yl)-1,3-benzoxazol-6-amine
CID 79881637
1-(1H-indol-2-yl)-3,4-dihydro-2H-quinoline
CID 70171146
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(furan-2-ylmethyl)thieno[3,4-d][1,3]thiazole-4-carboxamide
CID 121020870
4-(3,4-dihydro-2H-quinolin-1-yl)-3,5-difluorobenzoic acid
CID 63537981
ethane;1-phenyl-3,4-dihydro-2H-quinoline
CID 145126037

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline?
The IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline (CID 174697855) is 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline.
What is the SMILES notation for 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline?
The canonical SMILES for 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline is c1coc(-c2nc3ccccc3cc2N2CCCc3ccccc32)c1.
What is the InChIKey of 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline?
The InChIKey is ZWLDAJJBGDJKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O/c1-3-10-18-17(8-1)15-20(22(23-18)21-12-6-14-25-21)24-13-5-9-16-7-2-4-11-19(16)24/h1-4,6-8,10-12,14-15H,5,9,13H2.
What are the key properties of 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline?
3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline has a molecular weight of 326.40 g/mol, XLogP of 5.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-quinolin-1-yl)-2-(furan-2-yl)quinoline is sourced from PubChem (CID 174697855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).