2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol

C17H24ClNO — CID 83065461

IUPAC2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol
SMILESCC1(C)Cc2ccc(Cl)cc2C1NC1CCCCC1O
InChIInChI=1S/C17H24ClNO/c1-17(2)10-11-7-8-12(18)9-13(11)16(17)19-14-5-3-4-6-15(14)20/h7-9,14-16,19-20H,3-6,10H2,1-2H3
InChIKeyLSSXCEUSSITMTE-UHFFFAOYSA-N
MW293.84 g/mol
LogP3.86
Rot. Bonds2

About 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol

2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol (PubChem CID 83065461) has the molecular formula C17H24ClNO and a molecular weight of 293.84 g/mol. Its IUPAC name is 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol
PubChem CID83065461
Molecular FormulaC17H24ClNO
Molecular Weight293.84 g/mol
Exact Mass293.15
IUPAC Name2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol
SMILESCC1(C)Cc2ccc(Cl)cc2C1NC1CCCCC1O
InChIInChI=1S/C17H24ClNO/c1-17(2)10-11-7-8-12(18)9-13(11)16(17)19-14-5-3-4-6-15(14)20/h7-9,14-16,19-20H,3-6,10H2,1-2H3
InChIKeyLSSXCEUSSITMTE-UHFFFAOYSA-N
XLogP3.86
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.84
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol 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

2-((2,4,7-trichloro-9H-fluoren-9-yl)amino)ethanol
CID 283705
1-[[1-(3,4-dichlorophenyl)cyclohexyl]methylamino]-2,3-dihydro-1H-inden-2-ol
CID 68674733
2-[[3-(3,4-dichlorophenyl)-2,3-dihydro-1H-inden-1-yl]amino]ethanol;hydrochloride
CID 45260249
(1R,3aR,4S,5S,7aR)-5-[(3-chlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71582968
(1R,3aR,4S,5S,7aR)-5-[(2,4-dichlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71583074
(1R,3aR,4S,5S,7aR)-5-[(2,3-dichlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71583075
(1R,3aR,4R,5S,7aR)-5-[(3-chlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71583186
(1R,3aR,4R,5S,7aR)-5-[(2,4-dichlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71583189
(1R,3aR,4R,5S,7aR)-5-[(2,3-dichlorophenyl)methylamino]-3a,7a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7-hexahydro-1H-inden-4-ol
CID 71583190
2-[[(9R)-2,4,7-trichloro-9H-fluoren-9-yl]amino]ethanol
CID 3246472
2-[[3-(3,4-dichlorophenyl)-2,3-dihydro-1H-inden-1-yl]amino]ethanol
CID 13543894
(1R,2S)-1-[(4-chloro-3-fluorophenyl)methylamino]-2,3-dihydro-1H-inden-2-ol
CID 49463110

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol (CID 83065461) is 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol is CC1(C)Cc2ccc(Cl)cc2C1NC1CCCCC1O.
What is the InChIKey of 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol?
The InChIKey is LSSXCEUSSITMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO/c1-17(2)10-11-7-8-12(18)9-13(11)16(17)19-14-5-3-4-6-15(14)20/h7-9,14-16,19-20H,3-6,10H2,1-2H3.
What are the key properties of 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol?
2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol has a molecular weight of 293.84 g/mol, XLogP of 3.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 83065461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).