6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol

C10H16N2O3 — CID 79794461

IUPAC6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol
SMILESCOCC(O)CNCc1ccc(O)cn1
InChIInChI=1S/C10H16N2O3/c1-15-7-10(14)5-11-4-8-2-3-9(13)6-12-8/h2-3,6,10-11,13-14H,4-5,7H2,1H3
InChIKeyCPOVWRXHAVHTKI-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.12
Rot. Bonds6

About 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol

6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol (PubChem CID 79794461) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol
PubChem CID79794461
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol
SMILESCOCC(O)CNCc1ccc(O)cn1
InChIInChI=1S/C10H16N2O3/c1-15-7-10(14)5-11-4-8-2-3-9(13)6-12-8/h2-3,6,10-11,13-14H,4-5,7H2,1H3
InChIKeyCPOVWRXHAVHTKI-UHFFFAOYSA-N
XLogP-0.12
TPSA74.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol?
The IUPAC name of 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol (CID 79794461) is 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol?
The canonical SMILES for 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol is COCC(O)CNCc1ccc(O)cn1.
What is the InChIKey of 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol?
The InChIKey is CPOVWRXHAVHTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-15-7-10(14)5-11-4-8-2-3-9(13)6-12-8/h2-3,6,10-11,13-14H,4-5,7H2,1H3.
What are the key properties of 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol?
6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol has a molecular weight of 212.25 g/mol, XLogP of -0.12, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol is sourced from PubChem (CID 79794461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).