3-(3-chlorophenyl)-2,3-dihydro-1H-indole

C14H12ClN — CID 18675457

IUPAC3-(3-chlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1cccc(C2CNc3ccccc32)c1
InChIInChI=1S/C14H12ClN/c15-11-5-3-4-10(8-11)13-9-16-14-7-2-1-6-12(13)14/h1-8,13,16H,9H2
InChIKeyUTFSCMCPVQHOJE-UHFFFAOYSA-N
MW229.71 g/mol
LogP3.90
Rot. Bonds1

About 3-(3-chlorophenyl)-2,3-dihydro-1H-indole

3-(3-chlorophenyl)-2,3-dihydro-1H-indole (PubChem CID 18675457) has the molecular formula C14H12ClN and a molecular weight of 229.71 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name3-(3-chlorophenyl)-2,3-dihydro-1H-indole
PubChem CID18675457
Molecular FormulaC14H12ClN
Molecular Weight229.71 g/mol
Exact Mass229.07
IUPAC Name3-(3-chlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1cccc(C2CNc3ccccc32)c1
InChIInChI=1S/C14H12ClN/c15-11-5-3-4-10(8-11)13-9-16-14-7-2-1-6-12(13)14/h1-8,13,16H,9H2
InChIKeyUTFSCMCPVQHOJE-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(3-chlorophenyl)-1,3,4,5-tetrahydro-1,3-benzodiazepin-2-one
CID 15585559
(1R,3S)-1-chloro-3-(3-chlorophenyl)-2,3-dihydro-1H-indene
CID 129405682
(1R,3R)-1-chloro-3-(3-chlorophenyl)-2,3-dihydro-1H-indene
CID 129405683
3-[(3-chlorophenoxy)methyl]-2,3-dihydro-1H-indole
CID 115104047
5-(4-chlorophenyl)-1,3,4,5-tetrahydro-1,3-benzodiazepine-2-thione
CID 15585540
6-chloro-2-(2,3-dihydro-1H-indol-3-yl)-1-methylbenzimidazole
CID 115472337
5-bromo-3-phenyl-2,3-dihydro-1H-indole
CID 177342618
(3R)-3-(3-chlorophenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 129404863
7-chloro-2-(3-chlorophenyl)-3,4-dihydro-2H-1,4-benzoxazine
CID 81429876
(1R,4R)-4-(3-chlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine;(1S,4S)-4-(3-chlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 76969208
3-(3-chlorophenyl)azetidine;hydrochloride
CID 72698856
N-(3-chlorophenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573961

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The IUPAC name of 3-(3-chlorophenyl)-2,3-dihydro-1H-indole (CID 18675457) is 3-(3-chlorophenyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 3-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 3-(3-chlorophenyl)-2,3-dihydro-1H-indole is Clc1cccc(C2CNc3ccccc32)c1.
What is the InChIKey of 3-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The InChIKey is UTFSCMCPVQHOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN/c15-11-5-3-4-10(8-11)13-9-16-14-7-2-1-6-12(13)14/h1-8,13,16H,9H2.
What are the key properties of 3-(3-chlorophenyl)-2,3-dihydro-1H-indole?
3-(3-chlorophenyl)-2,3-dihydro-1H-indole has a molecular weight of 229.71 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 18675457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).