2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol

C12H19N3O — CID 107229186

IUPAC2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol
SMILESNc1cc(N2CCCC(CCO)C2)ccn1
InChIInChI=1S/C12H19N3O/c13-12-8-11(3-5-14-12)15-6-1-2-10(9-15)4-7-16/h3,5,8,10,16H,1-2,4,6-7,9H2,(H2,13,14)
InChIKeyGXRLMOWTQOIIMS-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.26
Rot. Bonds3

About 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol

2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol (PubChem CID 107229186) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol
PubChem CID107229186
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol
SMILESNc1cc(N2CCCC(CCO)C2)ccn1
InChIInChI=1S/C12H19N3O/c13-12-8-11(3-5-14-12)15-6-1-2-10(9-15)4-7-16/h3,5,8,10,16H,1-2,4,6-7,9H2,(H2,13,14)
InChIKeyGXRLMOWTQOIIMS-UHFFFAOYSA-N
XLogP1.26
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(4-aminopyrimidin-2-yl)piperidin-3-yl]ethanol
CID 107229189
2-[1-[(2-amino-4-pyridinyl)methyl]piperidin-3-yl]ethanol
CID 107167021
(2-amino-4-pyridinyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107228705
2-[1-[(2-amino-4-pyridinyl)sulfonyl]piperidin-3-yl]ethanol
CID 107228635
2-[1-[6-(aminomethyl)-3-pyridinyl]piperidin-3-yl]ethanol
CID 107227098
2-[1-[4-amino-3-(trifluoromethyl)phenyl]piperidin-3-yl]ethanol
CID 107226950
2-[1-(3-methylphenyl)piperidin-3-yl]ethanol
CID 117025976
2-[1-[4-(aminomethyl)phenyl]piperidin-3-yl]ethanol
CID 107227081
2-[1-(4-fluorophenyl)piperidin-3-yl]ethanol
CID 117025995
2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol
CID 107227792
4-(azepan-1-yl)pyridin-2-amine
CID 21059926
2-[1-(2-chloropyrimidin-4-yl)piperidin-3-yl]ethanol
CID 103761496

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol (CID 107229186) is 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol is Nc1cc(N2CCCC(CCO)C2)ccn1.
What is the InChIKey of 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol?
The InChIKey is GXRLMOWTQOIIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c13-12-8-11(3-5-14-12)15-6-1-2-10(9-15)4-7-16/h3,5,8,10,16H,1-2,4,6-7,9H2,(H2,13,14).
What are the key properties of 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol?
2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol has a molecular weight of 221.30 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol is sourced from PubChem (CID 107229186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).