2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol

C17H33NO2 — CID 106460190

IUPAC2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol
SMILESCC(C)COCCN1CCCCC1C1CCCCC1O
InChIInChI=1S/C17H33NO2/c1-14(2)13-20-12-11-18-10-6-5-8-16(18)15-7-3-4-9-17(15)19/h14-17,19H,3-13H2,1-2H3
InChIKeyLDGNGNXAQYWBFG-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.06
Rot. Bonds6

About 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol

2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol (PubChem CID 106460190) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol
PubChem CID106460190
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC Name2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol
SMILESCC(C)COCCN1CCCCC1C1CCCCC1O
InChIInChI=1S/C17H33NO2/c1-14(2)13-20-12-11-18-10-6-5-8-16(18)15-7-3-4-9-17(15)19/h14-17,19H,3-13H2,1-2H3
InChIKeyLDGNGNXAQYWBFG-UHFFFAOYSA-N
XLogP3.06
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[1-(3-methylbutyl)piperidin-2-yl]cyclohexan-1-ol
CID 114339739
[(2R)-1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]methanol
CID 100627976
2-(1-ethylpiperidin-2-yl)cyclohexan-1-ol
CID 114339807
2-(1-octylpiperidin-2-yl)cyclohexan-1-ol
CID 114339769
2-[1-(3-ethoxy-2-hydroxypropyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339580
2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]ethanamine
CID 106455021
2-[1-(2-hydroxy-3-propan-2-yloxypropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339076
2-[1-(3-hydroxy-2-methylpropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339118
2-[2-(2-hydroxycyclohexyl)piperidin-1-yl]-N-propan-2-ylacetamide
CID 114339958
2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]-1,3-thiazole
CID 122139894
2-[1-(3-methylsulfanylpropyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339633
3-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-N,N-dimethylpropanamide
CID 114340046

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol (CID 106460190) is 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol is CC(C)COCCN1CCCCC1C1CCCCC1O.
What is the InChIKey of 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol?
The InChIKey is LDGNGNXAQYWBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-14(2)13-20-12-11-18-10-6-5-8-16(18)15-7-3-4-9-17(15)19/h14-17,19H,3-13H2,1-2H3.
What are the key properties of 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol?
2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol has a molecular weight of 283.46 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 106460190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).