2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol

C19H29NO — CID 166350957

IUPAC2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol
SMILESCC(O)(CNCc1ccc2c(c1)CCC2)C1CCCCC1
InChIInChI=1S/C19H29NO/c1-19(21,18-8-3-2-4-9-18)14-20-13-15-10-11-16-6-5-7-17(16)12-15/h10-12,18,20-21H,2-9,13-14H2,1H3
InChIKeyWUFKIRPKRREGAE-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.60
Rot. Bonds5

About 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol

2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol (PubChem CID 166350957) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol.

Molecular Properties

Compound Name2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol
PubChem CID166350957
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol
SMILESCC(O)(CNCc1ccc2c(c1)CCC2)C1CCCCC1
InChIInChI=1S/C19H29NO/c1-19(21,18-8-3-2-4-9-18)14-20-13-15-10-11-16-6-5-7-17(16)12-15/h10-12,18,20-21H,2-9,13-14H2,1H3
InChIKeyWUFKIRPKRREGAE-UHFFFAOYSA-N
XLogP3.60
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-5-ylmethylamino)-2-(4-propan-2-ylcyclohexyl)propan-2-ol
CID 166351066
1-(2,3-dihydro-1H-inden-5-ylmethylamino)-3-(dimethylamino)-2-methylpropan-2-ol
CID 103838824
N-(2,3-dihydro-1H-inden-5-ylmethyl)-2,2,2-trifluoroethanamine
CID 60997427
1-cyclohexyl-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 114194209
1-cyclohexyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethylamino)ethanol
CID 166350994
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-1-amine
CID 43163737
N-[2-hydroxy-2-(4-methylcyclohexyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 166350982
(1S)-1-cycloheptyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)ethanamine
CID 81391872
2-cyclohexyl-2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)ethanamine
CID 166262817
2-cyclohexyl-1-(propylamino)propan-2-ol
CID 62775287
N-(2,3-dihydro-1H-inden-5-ylmethyl)-1-(2,2-dimethylcyclopropyl)methanamine
CID 113244920
N-[4-(2,3-dihydro-1H-inden-5-yl)-2,2-dimethylbutyl]cyclopropanamine
CID 65308901

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol?
The IUPAC name of 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol (CID 166350957) is 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol.
What is the SMILES notation for 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol?
The canonical SMILES for 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol is CC(O)(CNCc1ccc2c(c1)CCC2)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol?
The InChIKey is WUFKIRPKRREGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-19(21,18-8-3-2-4-9-18)14-20-13-15-10-11-16-6-5-7-17(16)12-15/h10-12,18,20-21H,2-9,13-14H2,1H3.
What are the key properties of 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol?
2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol has a molecular weight of 287.45 g/mol, XLogP of 3.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2,3-dihydro-1H-inden-5-ylmethylamino)propan-2-ol is sourced from PubChem (CID 166350957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).