(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol

C12H19N3O — CID 129499156

IUPAC(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol
SMILESC[C@@H](O)[C@H]1CCCCN1c1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-9(16)11-4-2-3-7-15(11)12-6-5-10(13)8-14-12/h5-6,8-9,11,16H,2-4,7,13H2,1H3/t9-,11-/m1/s1
InChIKeyRJDTVELNEYMXJK-MWLCHTKSSA-N
MW221.30 g/mol
LogP1.40
Rot. Bonds2

About (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol

(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol (PubChem CID 129499156) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol
PubChem CID129499156
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol
SMILESC[C@@H](O)[C@H]1CCCCN1c1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-9(16)11-4-2-3-7-15(11)12-6-5-10(13)8-14-12/h5-6,8-9,11,16H,2-4,7,13H2,1H3/t9-,11-/m1/s1
InChIKeyRJDTVELNEYMXJK-MWLCHTKSSA-N
XLogP1.40
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol?
The IUPAC name of (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol (CID 129499156) is (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol.
What is the SMILES notation for (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol?
The canonical SMILES for (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol is C[C@@H](O)[C@H]1CCCCN1c1ccc(N)cn1.
What is the InChIKey of (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol?
The InChIKey is RJDTVELNEYMXJK-MWLCHTKSSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(16)11-4-2-3-7-15(11)12-6-5-10(13)8-14-12/h5-6,8-9,11,16H,2-4,7,13H2,1H3/t9-,11-/m1/s1.
What are the key properties of (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol?
(1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol has a molecular weight of 221.30 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(2R)-1-(5-amino-2-pyridinyl)piperidin-2-yl]ethanol is sourced from PubChem (CID 129499156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).