(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone

C15H12ClNO — CID 116594499

IUPAC(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone
SMILESO=C(c1ccccc1Cl)C1CNc2ccccc21
InChIInChI=1S/C15H12ClNO/c16-13-7-3-1-6-11(13)15(18)12-9-17-14-8-4-2-5-10(12)14/h1-8,12,17H,9H2
InChIKeyWMCUYMMTFDTERN-UHFFFAOYSA-N
MW257.72 g/mol
LogP3.73
Rot. Bonds2

About (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone

(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone (PubChem CID 116594499) has the molecular formula C15H12ClNO and a molecular weight of 257.72 g/mol. Its IUPAC name is (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone
PubChem CID116594499
Molecular FormulaC15H12ClNO
Molecular Weight257.72 g/mol
Exact Mass257.06
IUPAC Name(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone
SMILESO=C(c1ccccc1Cl)C1CNc2ccccc21
InChIInChI=1S/C15H12ClNO/c16-13-7-3-1-6-11(13)15(18)12-9-17-14-8-4-2-5-10(12)14/h1-8,12,17H,9H2
InChIKeyWMCUYMMTFDTERN-UHFFFAOYSA-N
XLogP3.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichlorophenyl)-1-(2,3-dihydro-1H-indol-3-yl)ethanone
CID 107311420
2,3-dihydro-1H-indol-3-yl-(4-fluoro-2-methylphenyl)methanone
CID 116594740
2,3-dihydro-1H-indol-3-yl-(4-methoxy-2,5-dimethylphenyl)methanone
CID 116594634
2-(2,3-dihydro-1H-indol-3-yl)-2-oxoacetaldehyde;hydrobromide
CID 174877397
methyl 2,3-dihydro-1H-indole-3-carboxylate
CID 45073772
[4-(3,5-dichlorophenyl)-2-pyridinyl]-(2,3-dihydro-1H-indol-3-yl)methanone
CID 67218549
2,3-dihydro-1H-indol-3-yl-(3,5-dimethoxyphenyl)methanone
CID 116594626
(4-chloro-1-propylpyrazol-5-yl)-(2,3-dihydro-1H-indol-3-yl)methanone
CID 114670399
2,3-dihydro-1H-indol-3-yl(quinolin-3-yl)methanone
CID 116594537
2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2,3-dihydro-1H-indol-3-yl)ethanone
CID 116594603
N-(4-bromo-2-chlorophenyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80565893
2,3-dihydro-1H-indol-3-yl-(3-methoxy-2-pyridinyl)methanone
CID 114054329

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone?
The IUPAC name of (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone (CID 116594499) is (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone?
The canonical SMILES for (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone is O=C(c1ccccc1Cl)C1CNc2ccccc21.
What is the InChIKey of (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone?
The InChIKey is WMCUYMMTFDTERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO/c16-13-7-3-1-6-11(13)15(18)12-9-17-14-8-4-2-5-10(12)14/h1-8,12,17H,9H2.
What are the key properties of (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone?
(2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone has a molecular weight of 257.72 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(2,3-dihydro-1H-indol-3-yl)methanone is sourced from PubChem (CID 116594499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).