2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol

C12H26N2O — CID 53211565

IUPAC2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol
SMILESCCCNCCN1CCCCC1CCO
InChIInChI=1S/C12H26N2O/c1-2-7-13-8-10-14-9-4-3-5-12(14)6-11-15/h12-13,15H,2-11H2,1H3
InChIKeyVVPKVYKJACHHMV-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.22
Rot. Bonds7

About 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol

2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol (PubChem CID 53211565) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol
PubChem CID53211565
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol
SMILESCCCNCCN1CCCCC1CCO
InChIInChI=1S/C12H26N2O/c1-2-7-13-8-10-14-9-4-3-5-12(14)6-11-15/h12-13,15H,2-11H2,1H3
InChIKeyVVPKVYKJACHHMV-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-[2-(propylamino)ethyl]azepan-2-yl]methanol
CID 116637143
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
2-(1-octylpiperidin-2-yl)ethanol
CID 62020097
2-[1-[[1-(propylaminomethyl)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 62261936
[1-[2-(ethylamino)ethyl]azepan-2-yl]methanol
CID 116637146
N-[[(2R)-1-propylpiperidin-2-yl]methyl]propan-1-amine
CID 97017290
2-(1-pentylpyrrolidin-2-yl)ethanol
CID 117028513
6-[2-(2-hydroxyethyl)piperidin-1-yl]hexan-1-ol
CID 103737919
2-[1-(3-methylbut-3-enyl)piperidin-2-yl]ethanol
CID 114448957
4-[2-(2-hydroxyethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79361314
2-[1-(3-fluoropropyl)piperidin-2-yl]ethanol
CID 81113088
1-pentyl-2-propylpiperidine
CID 54429991

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol (CID 53211565) is 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol is CCCNCCN1CCCCC1CCO.
What is the InChIKey of 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol?
The InChIKey is VVPKVYKJACHHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-2-7-13-8-10-14-9-4-3-5-12(14)6-11-15/h12-13,15H,2-11H2,1H3.
What are the key properties of 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol?
2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol has a molecular weight of 214.35 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 53211565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).