3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone

C24H22N2O — CID 71679097

IUPAC3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone
SMILESCCn1c2ccccc2c2cc(C(=O)N3CCCc4ccccc43)ccc21
InChIInChI=1S/C24H22N2O/c1-2-25-22-12-6-4-10-19(22)20-16-18(13-14-23(20)25)24(27)26-15-7-9-17-8-3-5-11-21(17)26/h3-6,8,10-14,16H,2,7,9,15H2,1H3
InChIKeyFCYOAJHMZOQTGU-UHFFFAOYSA-N
MW354.45 g/mol
LogP5.41
Rot. Bonds2

About 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone

3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone (PubChem CID 71679097) has the molecular formula C24H22N2O and a molecular weight of 354.45 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone
PubChem CID71679097
Molecular FormulaC24H22N2O
Molecular Weight354.45 g/mol
Exact Mass354.17
IUPAC Name3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone
SMILESCCn1c2ccccc2c2cc(C(=O)N3CCCc4ccccc43)ccc21
InChIInChI=1S/C24H22N2O/c1-2-25-22-12-6-4-10-19(22)20-16-18(13-14-23(20)25)24(27)26-15-7-9-17-8-3-5-11-21(17)26/h3-6,8,10-14,16H,2,7,9,15H2,1H3
InChIKeyFCYOAJHMZOQTGU-UHFFFAOYSA-N
XLogP5.41
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.45
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone (CID 71679097) is 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone is CCn1c2ccccc2c2cc(C(=O)N3CCCc4ccccc43)ccc21.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone?
The InChIKey is FCYOAJHMZOQTGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O/c1-2-25-22-12-6-4-10-19(22)20-16-18(13-14-23(20)25)24(27)26-15-7-9-17-8-3-5-11-21(17)26/h3-6,8,10-14,16H,2,7,9,15H2,1H3.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone?
3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone has a molecular weight of 354.45 g/mol, XLogP of 5.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl-(9-ethylcarbazol-3-yl)methanone is sourced from PubChem (CID 71679097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).