2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol

C14H30N2O — CID 55051424

IUPAC2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol
SMILESCCNCC(C)(C)CN1CCCCC1CCO
InChIInChI=1S/C14H30N2O/c1-4-15-11-14(2,3)12-16-9-6-5-7-13(16)8-10-17/h13,15,17H,4-12H2,1-3H3
InChIKeySHZIGSWMCGMBJL-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.86
Rot. Bonds7

About 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol

2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol (PubChem CID 55051424) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol
PubChem CID55051424
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol
SMILESCCNCC(C)(C)CN1CCCCC1CCO
InChIInChI=1S/C14H30N2O/c1-4-15-11-14(2,3)12-16-9-6-5-7-13(16)8-10-17/h13,15,17H,4-12H2,1-3H3
InChIKeySHZIGSWMCGMBJL-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol (CID 55051424) is 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol is CCNCC(C)(C)CN1CCCCC1CCO.
What is the InChIKey of 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol?
The InChIKey is SHZIGSWMCGMBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-15-11-14(2,3)12-16-9-6-5-7-13(16)8-10-17/h13,15,17H,4-12H2,1-3H3.
What are the key properties of 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol?
2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol has a molecular weight of 242.41 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[3-(ethylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 55051424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).