2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol

C13H28N2O — CID 83994767

IUPAC2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol
SMILESCCC1CC(NCC(C)C)CN(CCO)C1
InChIInChI=1S/C13H28N2O/c1-4-12-7-13(14-8-11(2)3)10-15(9-12)5-6-16/h11-14,16H,4-10H2,1-3H3
InChIKeyRYBGBFBHZPDGSQ-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.32
Rot. Bonds6

About 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol

2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol (PubChem CID 83994767) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol
PubChem CID83994767
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol
SMILESCCC1CC(NCC(C)C)CN(CCO)C1
InChIInChI=1S/C13H28N2O/c1-4-12-7-13(14-8-11(2)3)10-15(9-12)5-6-16/h11-14,16H,4-10H2,1-3H3
InChIKeyRYBGBFBHZPDGSQ-UHFFFAOYSA-N
XLogP1.32
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(cyclopropylmethylamino)-5-ethylpiperidin-1-yl]ethanol
CID 83996841
N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide
CID 83994814
1-butyl-5-(cyclopropylmethyl)-N-(2-methylpropyl)piperidin-3-amine
CID 83994249
1-cyclopropyl-2-[5-(ethylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83990741
1-cyclohexyl-5-ethyl-N-(2-methylpropyl)piperidin-3-amine
CID 83994555
1-[1-ethyl-5-(2-methylpropylamino)piperidin-3-yl]-3-methylbutan-2-ol
CID 83994194
2-[3-(2,2-difluoroethylamino)-5-methylpiperidin-1-yl]ethanol
CID 83993383
1-[5-(ethylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83990738
3-[1-butyl-5-(2,2-difluoroethylamino)piperidin-3-yl]propan-1-ol
CID 83992872
methyl 2-[1-ethyl-5-(2-methylpropylamino)piperidin-3-yl]acetate
CID 83994184
2-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanol
CID 83991999
1-(cyclopropylmethyl)-5-ethyl-N-(3-methylbutyl)piperidin-3-amine
CID 83995985

Frequently Asked Questions

What is the IUPAC name of 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol?
The IUPAC name of 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol (CID 83994767) is 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol?
The canonical SMILES for 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol is CCC1CC(NCC(C)C)CN(CCO)C1.
What is the InChIKey of 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol?
The InChIKey is RYBGBFBHZPDGSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-12-7-13(14-8-11(2)3)10-15(9-12)5-6-16/h11-14,16H,4-10H2,1-3H3.
What are the key properties of 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol?
2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol has a molecular weight of 228.38 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol is sourced from PubChem (CID 83994767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).