6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one

C19H19FN2O — CID 50906599

IUPAC6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one
SMILESCCc1nc2c(c3c1[nH]c1cccc(F)c13)C(=O)CC(C)(C)C2
InChIInChI=1S/C19H19FN2O/c1-4-11-18-17(15-10(20)6-5-7-12(15)22-18)16-13(21-11)8-19(2,3)9-14(16)23/h5-7,22H,4,8-9H2,1-3H3
InChIKeyLICVPLAECONLKB-UHFFFAOYSA-N
MW310.37 g/mol
LogP4.57
Rot. Bonds1

About 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one

6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one (PubChem CID 50906599) has the molecular formula C19H19FN2O and a molecular weight of 310.37 g/mol. Its IUPAC name is 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one.

Molecular Properties

Compound Name6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one
PubChem CID50906599
Molecular FormulaC19H19FN2O
Molecular Weight310.37 g/mol
Exact Mass310.15
IUPAC Name6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one
SMILESCCc1nc2c(c3c1[nH]c1cccc(F)c13)C(=O)CC(C)(C)C2
InChIInChI=1S/C19H19FN2O/c1-4-11-18-17(15-10(20)6-5-7-12(15)22-18)16-13(21-11)8-19(2,3)9-14(16)23/h5-7,22H,4,8-9H2,1-3H3
InChIKeyLICVPLAECONLKB-UHFFFAOYSA-N
XLogP4.57
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one?
The IUPAC name of 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one (CID 50906599) is 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one.
What is the SMILES notation for 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one?
The canonical SMILES for 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one is CCc1nc2c(c3c1[nH]c1cccc(F)c13)C(=O)CC(C)(C)C2.
What is the InChIKey of 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one?
The InChIKey is LICVPLAECONLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O/c1-4-11-18-17(15-10(20)6-5-7-12(15)22-18)16-13(21-11)8-19(2,3)9-14(16)23/h5-7,22H,4,8-9H2,1-3H3.
What are the key properties of 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one?
6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one has a molecular weight of 310.37 g/mol, XLogP of 4.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-11-fluoro-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one is sourced from PubChem (CID 50906599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).