(2-bromophenyl)-carbazol-9-ylmethanone

C19H12BrNO — CID 3717586

IUPAC(2-bromophenyl)-carbazol-9-ylmethanone
SMILESO=C(c1ccccc1Br)n1c2ccccc2c2ccccc21
InChIInChI=1S/C19H12BrNO/c20-16-10-4-1-9-15(16)19(22)21-17-11-5-2-7-13(17)14-8-3-6-12-18(14)21/h1-12H
InChIKeyDLCQNRDYPOAMGK-UHFFFAOYSA-N
MW350.22 g/mol
LogP5.25
Rot. Bonds1

About (2-bromophenyl)-carbazol-9-ylmethanone

(2-bromophenyl)-carbazol-9-ylmethanone (PubChem CID 3717586) has the molecular formula C19H12BrNO and a molecular weight of 350.22 g/mol. Its IUPAC name is (2-bromophenyl)-carbazol-9-ylmethanone.

Molecular Properties

Compound Name(2-bromophenyl)-carbazol-9-ylmethanone
PubChem CID3717586
Molecular FormulaC19H12BrNO
Molecular Weight350.22 g/mol
Exact Mass349.01
IUPAC Name(2-bromophenyl)-carbazol-9-ylmethanone
SMILESO=C(c1ccccc1Br)n1c2ccccc2c2ccccc21
InChIInChI=1S/C19H12BrNO/c20-16-10-4-1-9-15(16)19(22)21-17-11-5-2-7-13(17)14-8-3-6-12-18(14)21/h1-12H
InChIKeyDLCQNRDYPOAMGK-UHFFFAOYSA-N
XLogP5.25
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.22
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-carbazol-9-ylmethanone?
The IUPAC name of (2-bromophenyl)-carbazol-9-ylmethanone (CID 3717586) is (2-bromophenyl)-carbazol-9-ylmethanone.
What is the SMILES notation for (2-bromophenyl)-carbazol-9-ylmethanone?
The canonical SMILES for (2-bromophenyl)-carbazol-9-ylmethanone is O=C(c1ccccc1Br)n1c2ccccc2c2ccccc21.
What is the InChIKey of (2-bromophenyl)-carbazol-9-ylmethanone?
The InChIKey is DLCQNRDYPOAMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12BrNO/c20-16-10-4-1-9-15(16)19(22)21-17-11-5-2-7-13(17)14-8-3-6-12-18(14)21/h1-12H.
What are the key properties of (2-bromophenyl)-carbazol-9-ylmethanone?
(2-bromophenyl)-carbazol-9-ylmethanone has a molecular weight of 350.22 g/mol, XLogP of 5.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-carbazol-9-ylmethanone is sourced from PubChem (CID 3717586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).