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

C14H23N3O — CID 107227792

IUPAC2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol
SMILESCC(N)c1ccnc(N2CCCC(CCO)C2)c1
InChIInChI=1S/C14H23N3O/c1-11(15)13-4-6-16-14(9-13)17-7-2-3-12(10-17)5-8-18/h4,6,9,11-12,18H,2-3,5,7-8,10,15H2,1H3
InChIKeyUCQNIANYYJIRQO-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.70
Rot. Bonds4

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

2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol (PubChem CID 107227792) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol
PubChem CID107227792
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol
SMILESCC(N)c1ccnc(N2CCCC(CCO)C2)c1
InChIInChI=1S/C14H23N3O/c1-11(15)13-4-6-16-14(9-13)17-7-2-3-12(10-17)5-8-18/h4,6,9,11-12,18H,2-3,5,7-8,10,15H2,1H3
InChIKeyUCQNIANYYJIRQO-UHFFFAOYSA-N
XLogP1.70
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-methylsulfanylazepan-1-yl)-4-pyridinyl]ethanamine
CID 114237251
[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]morpholin-2-yl]methanol
CID 81205057
2-[1-[5-[1-(methylamino)ethyl]-2-pyridinyl]piperidin-3-yl]ethanol
CID 107227771
2-[1-(2-chloropyrimidin-4-yl)piperidin-3-yl]ethanol
CID 103761496
2-[1-(2-amino-4-pyridinyl)piperidin-3-yl]ethanol
CID 107229186
2-[1-(4-aminopyrimidin-2-yl)piperidin-3-yl]ethanol
CID 107229189
[1-[4-[1-(methylamino)ethyl]-2-pyridinyl]pyrrolidin-3-yl]methanol
CID 112626014
1-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-3-methylpiperidin-3-ol
CID 104876735
2-[1-(6-amino-5-methylpyrimidin-4-yl)piperidin-3-yl]ethanol
CID 107229203
1-[4-[(1R)-1-aminoethyl]-2-pyridinyl]-3-methylpiperidin-3-ol
CID 104876717
2-[1-[2-(1-aminoethyl)-4-fluoro-5-methylphenyl]piperidin-3-yl]ethanol
CID 107227741
2-[1-[3-(1-aminoethyl)phenyl]sulfonylpiperidin-3-yl]ethanol
CID 107227828

Frequently Asked Questions

What is the IUPAC name of 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol (CID 107227792) is 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol is CC(N)c1ccnc(N2CCCC(CCO)C2)c1.
What is the InChIKey of 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol?
The InChIKey is UCQNIANYYJIRQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-11(15)13-4-6-16-14(9-13)17-7-2-3-12(10-17)5-8-18/h4,6,9,11-12,18H,2-3,5,7-8,10,15H2,1H3.
What are the key properties of 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol?
2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol has a molecular weight of 249.36 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[4-(1-aminoethyl)-2-pyridinyl]piperidin-3-yl]ethanol is sourced from PubChem (CID 107227792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).