(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride

C15H20Cl2N2O — CID 119760507

IUPAC(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride
SMILESCl.NC1CCCC(C(=O)N2CCc3ccc(Cl)cc32)C1
InChIInChI=1S/C15H19ClN2O.ClH/c16-12-5-4-10-6-7-18(14(10)9-12)15(19)11-2-1-3-13(17)8-11;/h4-5,9,11,13H,1-3,6-8,17H2;1H
InChIKeyWFXSWBXYIRWJIT-UHFFFAOYSA-N
MW315.24 g/mol
LogP3.17
Rot. Bonds1

About (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride

(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride (PubChem CID 119760507) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride.

Molecular Properties

Compound Name(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride
PubChem CID119760507
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride
SMILESCl.NC1CCCC(C(=O)N2CCc3ccc(Cl)cc32)C1
InChIInChI=1S/C15H19ClN2O.ClH/c16-12-5-4-10-6-7-18(14(10)9-12)15(19)11-2-1-3-13(17)8-11;/h4-5,9,11,13H,1-3,6-8,17H2;1H
InChIKeyWFXSWBXYIRWJIT-UHFFFAOYSA-N
XLogP3.17
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(1R,3R)-3-aminocyclopentyl]-(6-chloro-2,3-dihydroindol-1-yl)methanone
CID 124699729
(3-aminocyclohexyl)-(2,3-dihydroindol-1-yl)methanone;hydrochloride
CID 119673091
(3-aminocyclohexyl)-(4-chloro-2,3-dihydroindol-1-yl)methanone
CID 119788766
1-(3-aminocyclopentanecarbonyl)-N-methyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
CID 119802266
6-chloro-2,3-dihydroindole-1-carbonyl chloride
CID 139548954
1-[(1S,3S)-3-aminocyclopentanecarbonyl]-N-methyl-2,3-dihydroindole-6-sulfonamide
CID 124689464
3-(6-fluoro-2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylic acid
CID 103953312
(3-aminocyclopentyl)-(4-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride
CID 119788761
1-(3-aminocyclohexanecarbonyl)-N,N-diethyl-2,3-dihydroindole-5-sulfonamide
CID 119696140
(7-amino-3,4-dihydro-2H-quinolin-1-yl)-cyclobutylmethanone
CID 55055284
(3-aminocyclopentyl)-(5-tert-butyl-2,3-dihydroindol-1-yl)methanone
CID 119765893
3-amino-1-(6-chloro-2,3-dihydroindol-1-yl)propan-1-one
CID 119310127

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride?
The IUPAC name of (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride (CID 119760507) is (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride.
What is the SMILES notation for (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride?
The canonical SMILES for (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride is Cl.NC1CCCC(C(=O)N2CCc3ccc(Cl)cc32)C1.
What is the InChIKey of (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride?
The InChIKey is WFXSWBXYIRWJIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O.ClH/c16-12-5-4-10-6-7-18(14(10)9-12)15(19)11-2-1-3-13(17)8-11;/h4-5,9,11,13H,1-3,6-8,17H2;1H.
What are the key properties of (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride?
(3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride has a molecular weight of 315.24 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclohexyl)-(6-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride is sourced from PubChem (CID 119760507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).