2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone

C19H15FN2O — CID 664825

IUPAC2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone
SMILESCc1cc(C(=O)N2CCc3ccccc32)c2cc(F)ccc2n1
InChIInChI=1S/C19H15FN2O/c1-12-10-16(15-11-14(20)6-7-17(15)21-12)19(23)22-9-8-13-4-2-3-5-18(13)22/h2-7,10-11H,8-9H2,1H3
InChIKeyBFVWWCZCYHAJBI-UHFFFAOYSA-N
MW306.34 g/mol
LogP3.89
Rot. Bonds1

About 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone

2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone (PubChem CID 664825) has the molecular formula C19H15FN2O and a molecular weight of 306.34 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone
PubChem CID664825
Molecular FormulaC19H15FN2O
Molecular Weight306.34 g/mol
Exact Mass306.12
IUPAC Name2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone
SMILESCc1cc(C(=O)N2CCc3ccccc32)c2cc(F)ccc2n1
InChIInChI=1S/C19H15FN2O/c1-12-10-16(15-11-14(20)6-7-17(15)21-12)19(23)22-9-8-13-4-2-3-5-18(13)22/h2-7,10-11H,8-9H2,1H3
InChIKeyBFVWWCZCYHAJBI-UHFFFAOYSA-N
XLogP3.89
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azepan-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone
CID 4732287
2,3-dihydroindol-1-yl-[2-(5-methylfuran-2-yl)quinolin-4-yl]methanone
CID 3372702
(2-methylquinolin-4-yl)-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 31840743
[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 2-methylquinoline-4-carboxylate
CID 6915560
6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
CID 4732291
(2,4-difluorophenyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 736346
(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone
CID 4815727
2,3-dihydroindol-1-yl-(6-methyl-2-pyridinyl)methanone
CID 33315959
(2-methylquinolin-4-yl)-(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 60530096
(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(2-methylphenyl)methanone
CID 47168679
2,3-dihydroindol-1-yl-(3-fluoro-4-methylphenyl)methanone
CID 17476941
3-(2,3-dihydroindole-1-carbonyl)benzoic acid
CID 43452867

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone (CID 664825) is 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone is Cc1cc(C(=O)N2CCc3ccccc32)c2cc(F)ccc2n1.
What is the InChIKey of 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone?
The InChIKey is BFVWWCZCYHAJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O/c1-12-10-16(15-11-14(20)6-7-17(15)21-12)19(23)22-9-8-13-4-2-3-5-18(13)22/h2-7,10-11H,8-9H2,1H3.
What are the key properties of 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone?
2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone has a molecular weight of 306.34 g/mol, XLogP of 3.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone is sourced from PubChem (CID 664825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).