4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol

C8H12N2O2 — CID 55294329

IUPAC4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol
SMILESCOC[C@@H](N)c1ccncc1O
InChIInChI=1S/C8H12N2O2/c1-12-5-7(9)6-2-3-10-4-8(6)11/h2-4,7,11H,5,9H2,1H3/t7-/m1/s1
InChIKeyUZSIOPLPTAZRPD-SSDOTTSWSA-N
MW168.20 g/mol
LogP0.43
Rot. Bonds3

About 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol

4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol (PubChem CID 55294329) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol.

Molecular Properties

Compound Name4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol
PubChem CID55294329
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol
SMILESCOC[C@@H](N)c1ccncc1O
InChIInChI=1S/C8H12N2O2/c1-12-5-7(9)6-2-3-10-4-8(6)11/h2-4,7,11H,5,9H2,1H3/t7-/m1/s1
InChIKeyUZSIOPLPTAZRPD-SSDOTTSWSA-N
XLogP0.43
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-2-methoxy-1-(4-methyl-3-pyridinyl)ethanamine
CID 55292197
(1R)-1-(4-chloro-3-pyridinyl)-2-methoxyethanamine
CID 55271212
3-amino-3-(3-hydroxy-4-pyridinyl)propanoic acid
CID 55293779
2-[(1S)-1-amino-2-methoxyethyl]-5-methylphenol
CID 55293424
4-(dimethoxymethyl)pyridin-3-ol
CID 86690788
1-(3-methoxy-4-pyridinyl)-2-propoxyethanamine
CID 105065820
4-amino-2-(1-amino-2-methoxyethyl)phenol
CID 55294234
[2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261958
[1-(3-ethyl-4-pyridinyl)-2-methoxyethyl]hydrazine
CID 105262260
1-(3-fluoro-4-pyridinyl)-3-methoxypropan-1-ol
CID 104737985
2-amino-2-(3-hydroxy-4-pyridinyl)acetic acid
CID 55293514
6-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol
CID 55293682

Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol?
The IUPAC name of 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol (CID 55294329) is 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol.
What is the SMILES notation for 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol?
The canonical SMILES for 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol is COC[C@@H](N)c1ccncc1O.
What is the InChIKey of 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol?
The InChIKey is UZSIOPLPTAZRPD-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-12-5-7(9)6-2-3-10-4-8(6)11/h2-4,7,11H,5,9H2,1H3/t7-/m1/s1.
What are the key properties of 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol?
4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol has a molecular weight of 168.20 g/mol, XLogP of 0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S)-1-amino-2-methoxyethyl]pyridin-3-ol is sourced from PubChem (CID 55294329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).