(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone

C24H18N2O — CID 71679426

IUPAC(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone
SMILESCCn1c2ccccc2c2cc(C(=O)c3cccc4ncccc34)ccc21
InChIInChI=1S/C24H18N2O/c1-2-26-22-11-4-3-7-18(22)20-15-16(12-13-23(20)26)24(27)19-8-5-10-21-17(19)9-6-14-25-21/h3-15H,2H2,1H3
InChIKeyPVXVLICZYVCCKQ-UHFFFAOYSA-N
MW350.42 g/mol
LogP5.59
Rot. Bonds3

About (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone

(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone (PubChem CID 71679426) has the molecular formula C24H18N2O and a molecular weight of 350.42 g/mol. Its IUPAC name is (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone.

Molecular Properties

Compound Name(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone
PubChem CID71679426
Molecular FormulaC24H18N2O
Molecular Weight350.42 g/mol
Exact Mass350.14
IUPAC Name(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone
SMILESCCn1c2ccccc2c2cc(C(=O)c3cccc4ncccc34)ccc21
InChIInChI=1S/C24H18N2O/c1-2-26-22-11-4-3-7-18(22)20-15-16(12-13-23(20)26)24(27)19-8-5-10-21-17(19)9-6-14-25-21/h3-15H,2H2,1H3
InChIKeyPVXVLICZYVCCKQ-UHFFFAOYSA-N
XLogP5.59
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.42
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone?
The IUPAC name of (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone (CID 71679426) is (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone.
What is the SMILES notation for (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone?
The canonical SMILES for (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone is CCn1c2ccccc2c2cc(C(=O)c3cccc4ncccc34)ccc21.
What is the InChIKey of (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone?
The InChIKey is PVXVLICZYVCCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O/c1-2-26-22-11-4-3-7-18(22)20-15-16(12-13-23(20)26)24(27)19-8-5-10-21-17(19)9-6-14-25-21/h3-15H,2H2,1H3.
What are the key properties of (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone?
(9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone has a molecular weight of 350.42 g/mol, XLogP of 5.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (9-ethylcarbazol-3-yl)-quinolin-5-ylmethanone is sourced from PubChem (CID 71679426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).