2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride

C8H13ClN2O2 — CID 162337184

IUPAC2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride
SMILESCl.N[C@@H](CO)Cc1ncccc1O
InChIInChI=1S/C8H12N2O2.ClH/c9-6(5-11)4-7-8(12)2-1-3-10-7;/h1-3,6,11-12H,4-5,9H2;1H/t6-;/m1./s1
InChIKeyKYXUNXXICWGXRH-FYZOBXCZSA-N
MW204.66 g/mol
LogP0.07
Rot. Bonds3

About 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride

2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride (PubChem CID 162337184) has the molecular formula C8H13ClN2O2 and a molecular weight of 204.66 g/mol. Its IUPAC name is 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride
PubChem CID162337184
Molecular FormulaC8H13ClN2O2
Molecular Weight204.66 g/mol
Exact Mass204.07
IUPAC Name2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride
SMILESCl.N[C@@H](CO)Cc1ncccc1O
InChIInChI=1S/C8H12N2O2.ClH/c9-6(5-11)4-7-8(12)2-1-3-10-7;/h1-3,6,11-12H,4-5,9H2;1H/t6-;/m1./s1
InChIKeyKYXUNXXICWGXRH-FYZOBXCZSA-N
XLogP0.07
TPSA79.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride?
The IUPAC name of 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride (CID 162337184) is 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride.
What is the SMILES notation for 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride?
The canonical SMILES for 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride is Cl.N[C@@H](CO)Cc1ncccc1O.
What is the InChIKey of 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride?
The InChIKey is KYXUNXXICWGXRH-FYZOBXCZSA-N. The full InChI is InChI=1S/C8H12N2O2.ClH/c9-6(5-11)4-7-8(12)2-1-3-10-7;/h1-3,6,11-12H,4-5,9H2;1H/t6-;/m1./s1.
What are the key properties of 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride?
2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride has a molecular weight of 204.66 g/mol, XLogP of 0.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-amino-3-hydroxypropyl]pyridin-3-ol;hydrochloride is sourced from PubChem (CID 162337184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).