[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol

C16H22ClNO — CID 103785054

IUPAC[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol
SMILESOCC1CCCCC1NC1CCc2cc(Cl)ccc21
InChIInChI=1S/C16H22ClNO/c17-13-6-7-14-11(9-13)5-8-16(14)18-15-4-2-1-3-12(15)10-19/h6-7,9,12,15-16,18-19H,1-5,8,10H2
InChIKeyHGLZUFRVNKULOE-UHFFFAOYSA-N
MW279.81 g/mol
LogP3.47
Rot. Bonds3

About [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol

[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol (PubChem CID 103785054) has the molecular formula C16H22ClNO and a molecular weight of 279.81 g/mol. Its IUPAC name is [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol
PubChem CID103785054
Molecular FormulaC16H22ClNO
Molecular Weight279.81 g/mol
Exact Mass279.14
IUPAC Name[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol
SMILESOCC1CCCCC1NC1CCc2cc(Cl)ccc21
InChIInChI=1S/C16H22ClNO/c17-13-6-7-14-11(9-13)5-8-16(14)18-15-4-2-1-3-12(15)10-19/h6-7,9,12,15-16,18-19H,1-5,8,10H2
InChIKeyHGLZUFRVNKULOE-UHFFFAOYSA-N
XLogP3.47
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.81
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol with MolForge

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Related Compounds

5-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 81301651
[2-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol
CID 103785029
[2-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)amino]cyclopentyl]methanol
CID 103786082
5-chloro-N-(2-methylsulfanylcyclopentyl)-2,3-dihydro-1H-inden-1-amine
CID 113262270
[(1R,2S)-2-[[(1R)-4-bromo-2,3-dihydro-1H-inden-1-yl]amino]cyclopentyl]methanol
CID 98875815
[2-[(6,8-dichloro-3,4-dihydro-2H-chromen-4-yl)amino]cyclohexyl]methanol
CID 103785053
3-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 81338301
[1-[[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]methyl]cyclohexyl]methanol
CID 115892903
N'-(5-chloro-2,3-dihydro-1H-inden-1-yl)ethane-1,2-diamine;hydrochloride
CID 139930761
2-amino-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)acetamide
CID 119300808
(2R)-1-[[(1S)-5-chloro-2,3-dihydro-1H-inden-1-yl]amino]propan-2-ol
CID 97357898
6-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 115867576

Frequently Asked Questions

What is the IUPAC name of [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol (CID 103785054) is [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol is OCC1CCCCC1NC1CCc2cc(Cl)ccc21.
What is the InChIKey of [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol?
The InChIKey is HGLZUFRVNKULOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClNO/c17-13-6-7-14-11(9-13)5-8-16(14)18-15-4-2-1-3-12(15)10-19/h6-7,9,12,15-16,18-19H,1-5,8,10H2.
What are the key properties of [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol?
[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol has a molecular weight of 279.81 g/mol, XLogP of 3.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 103785054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).