(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone

C23H21NO — CID 141364067

IUPAC(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone
SMILESCCc1ccccc1C(=O)c1ccc2c(c1)c1ccccc1n2CC
InChIInChI=1S/C23H21NO/c1-3-16-9-5-6-10-18(16)23(25)17-13-14-22-20(15-17)19-11-7-8-12-21(19)24(22)4-2/h5-15H,3-4H2,1-2H3
InChIKeyCIORSEURQPWQBC-UHFFFAOYSA-N
MW327.43 g/mol
LogP5.61
Rot. Bonds4

About (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone

(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone (PubChem CID 141364067) has the molecular formula C23H21NO and a molecular weight of 327.43 g/mol. Its IUPAC name is (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone.

Molecular Properties

Compound Name(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone
PubChem CID141364067
Molecular FormulaC23H21NO
Molecular Weight327.43 g/mol
Exact Mass327.16
IUPAC Name(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone
SMILESCCc1ccccc1C(=O)c1ccc2c(c1)c1ccccc1n2CC
InChIInChI=1S/C23H21NO/c1-3-16-9-5-6-10-18(16)23(25)17-13-14-22-20(15-17)19-11-7-8-12-21(19)24(22)4-2/h5-15H,3-4H2,1-2H3
InChIKeyCIORSEURQPWQBC-UHFFFAOYSA-N
XLogP5.61
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.43
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone?
The IUPAC name of (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone (CID 141364067) is (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone.
What is the SMILES notation for (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone?
The canonical SMILES for (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone is CCc1ccccc1C(=O)c1ccc2c(c1)c1ccccc1n2CC.
What is the InChIKey of (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone?
The InChIKey is CIORSEURQPWQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO/c1-3-16-9-5-6-10-18(16)23(25)17-13-14-22-20(15-17)19-11-7-8-12-21(19)24(22)4-2/h5-15H,3-4H2,1-2H3.
What are the key properties of (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone?
(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone has a molecular weight of 327.43 g/mol, XLogP of 5.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone is sourced from PubChem (CID 141364067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).