(6-chloro-1H-indol-2-yl)-phenylmethanone

C15H10ClNO — CID 23003423

IUPAC(6-chloro-1H-indol-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C15H10ClNO/c16-12-7-6-11-8-14(17-13(11)9-12)15(18)10-4-2-1-3-5-10/h1-9,17H
InChIKeyQXGLGNQMXTXNJS-UHFFFAOYSA-N
MW255.70 g/mol
LogP4.05
Rot. Bonds2

About (6-chloro-1H-indol-2-yl)-phenylmethanone

(6-chloro-1H-indol-2-yl)-phenylmethanone (PubChem CID 23003423) has the molecular formula C15H10ClNO and a molecular weight of 255.70 g/mol. Its IUPAC name is (6-chloro-1H-indol-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(6-chloro-1H-indol-2-yl)-phenylmethanone
PubChem CID23003423
Molecular FormulaC15H10ClNO
Molecular Weight255.70 g/mol
Exact Mass255.05
IUPAC Name(6-chloro-1H-indol-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C15H10ClNO/c16-12-7-6-11-8-14(17-13(11)9-12)15(18)10-4-2-1-3-5-10/h1-9,17H
InChIKeyQXGLGNQMXTXNJS-UHFFFAOYSA-N
XLogP4.05
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6-chloro-1H-indol-2-yl)-phenylmethanone?
The IUPAC name of (6-chloro-1H-indol-2-yl)-phenylmethanone (CID 23003423) is (6-chloro-1H-indol-2-yl)-phenylmethanone.
What is the SMILES notation for (6-chloro-1H-indol-2-yl)-phenylmethanone?
The canonical SMILES for (6-chloro-1H-indol-2-yl)-phenylmethanone is O=C(c1ccccc1)c1cc2ccc(Cl)cc2[nH]1.
What is the InChIKey of (6-chloro-1H-indol-2-yl)-phenylmethanone?
The InChIKey is QXGLGNQMXTXNJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNO/c16-12-7-6-11-8-14(17-13(11)9-12)15(18)10-4-2-1-3-5-10/h1-9,17H.
What are the key properties of (6-chloro-1H-indol-2-yl)-phenylmethanone?
(6-chloro-1H-indol-2-yl)-phenylmethanone has a molecular weight of 255.70 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1H-indol-2-yl)-phenylmethanone is sourced from PubChem (CID 23003423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).