(5,6-dichloro-1H-indol-2-yl)-phenylmethanone

C15H9Cl2NO — CID 23003502

IUPAC(5,6-dichloro-1H-indol-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc2cc(Cl)c(Cl)cc2[nH]1
InChIInChI=1S/C15H9Cl2NO/c16-11-6-10-7-14(18-13(10)8-12(11)17)15(19)9-4-2-1-3-5-9/h1-8,18H
InChIKeySBFFCCCKUJPKTJ-UHFFFAOYSA-N
MW290.15 g/mol
LogP4.71
Rot. Bonds2

About (5,6-dichloro-1H-indol-2-yl)-phenylmethanone

(5,6-dichloro-1H-indol-2-yl)-phenylmethanone (PubChem CID 23003502) has the molecular formula C15H9Cl2NO and a molecular weight of 290.15 g/mol. Its IUPAC name is (5,6-dichloro-1H-indol-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(5,6-dichloro-1H-indol-2-yl)-phenylmethanone
PubChem CID23003502
Molecular FormulaC15H9Cl2NO
Molecular Weight290.15 g/mol
Exact Mass289.01
IUPAC Name(5,6-dichloro-1H-indol-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cc2cc(Cl)c(Cl)cc2[nH]1
InChIInChI=1S/C15H9Cl2NO/c16-11-6-10-7-14(18-13(10)8-12(11)17)15(19)9-4-2-1-3-5-9/h1-8,18H
InChIKeySBFFCCCKUJPKTJ-UHFFFAOYSA-N
XLogP4.71
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.15
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-(1H-indole-2-carbonyl)phenyl]ethanone
CID 139733709
(7-methyl-1H-indol-2-yl)-phenylmethanone
CID 13184984
(5-methyl-1H-indol-2-yl)-(4-methylphenyl)methanone
CID 59088766
6-chloro-5-iodo-1H-indole-2-carboxamide
CID 135396268
2-carbamoyl-1H-indole-6-carboxylic acid
CID 70896199
2,5-bis(1H-indole-2-carbonyl)terephthalic acid
CID 70529357
2-chloro-5-(5,6-dichloro-1H-indol-2-yl)benzoic acid
CID 11393662
diphenylmethanone
CID 3102
anthracene;diphenylmethanone
CID 87408663
5,6-dichloro-N-[3-[(5-fluoro-6-oxo-1H-pyridine-3-carbonyl)amino]phenyl]-1H-indole-2-carboxamide
CID 166378280
(2-chlorophenyl)-phenylmethanone;diphenylmethanone
CID 157388336
2-[2-(1H-indol-2-yl)-1,2-diphenylethenyl]-1H-indole
CID 141243954

Frequently Asked Questions

What is the IUPAC name of (5,6-dichloro-1H-indol-2-yl)-phenylmethanone?
The IUPAC name of (5,6-dichloro-1H-indol-2-yl)-phenylmethanone (CID 23003502) is (5,6-dichloro-1H-indol-2-yl)-phenylmethanone.
What is the SMILES notation for (5,6-dichloro-1H-indol-2-yl)-phenylmethanone?
The canonical SMILES for (5,6-dichloro-1H-indol-2-yl)-phenylmethanone is O=C(c1ccccc1)c1cc2cc(Cl)c(Cl)cc2[nH]1.
What is the InChIKey of (5,6-dichloro-1H-indol-2-yl)-phenylmethanone?
The InChIKey is SBFFCCCKUJPKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NO/c16-11-6-10-7-14(18-13(10)8-12(11)17)15(19)9-4-2-1-3-5-9/h1-8,18H.
What are the key properties of (5,6-dichloro-1H-indol-2-yl)-phenylmethanone?
(5,6-dichloro-1H-indol-2-yl)-phenylmethanone has a molecular weight of 290.15 g/mol, XLogP of 4.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5,6-dichloro-1H-indol-2-yl)-phenylmethanone is sourced from PubChem (CID 23003502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).