(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol

C9H11ClN2O2 — CID 130523883

IUPAC(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol
SMILESO[C@H]1CON(Cc2ccc(Cl)nc2)C1
InChIInChI=1S/C9H11ClN2O2/c10-9-2-1-7(3-11-9)4-12-5-8(13)6-14-12/h1-3,8,13H,4-6H2/t8-/m1/s1
InChIKeyFEXMRFNOSUAHJR-MRVPVSSYSA-N
MW214.65 g/mol
LogP0.84
Rot. Bonds2

About (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol

(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol (PubChem CID 130523883) has the molecular formula C9H11ClN2O2 and a molecular weight of 214.65 g/mol. Its IUPAC name is (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol.

Molecular Properties

Compound Name(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol
PubChem CID130523883
Molecular FormulaC9H11ClN2O2
Molecular Weight214.65 g/mol
Exact Mass214.05
IUPAC Name(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol
SMILESO[C@H]1CON(Cc2ccc(Cl)nc2)C1
InChIInChI=1S/C9H11ClN2O2/c10-9-2-1-7(3-11-9)4-12-5-8(13)6-14-12/h1-3,8,13H,4-6H2/t8-/m1/s1
InChIKeyFEXMRFNOSUAHJR-MRVPVSSYSA-N
XLogP0.84
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

1-[(6-chloro-3-pyridinyl)methyl]-4-methylpiperidin-3-ol
CID 103898564
2-chloro-5-(1,2,4-triazol-4-ylmethyl)pyridine
CID 178122205
1,3,5-tris[(6-chloro-3-pyridinyl)methyl]triazinane
CID 87655819
2-[(5-chlorothiadiazol-4-yl)methyl]-1,2-oxazolidin-4-ol
CID 130523432
1-[(6-chloro-3-pyridinyl)methyl]piperidin-4-amine
CID 43556713
1-[(6-chloro-3-pyridinyl)methyl]-4-sulfanylpyrrolidin-2-one
CID 168709493
[1-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 60582294
1,7-bis[(6-chloro-3-pyridinyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102314847
1-[1-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-yl]propan-2-ol
CID 113321888
(3R)-1-[(6-chloro-3-pyridinyl)methyl]-N-methylpiperidin-3-amine
CID 94476054
8-amino-1-[(6-chloro-3-pyridinyl)methyl]-3,5,6,7,8,8a-hexahydro-2H-imidazo[1,2-a]pyridine-5,7-diol
CID 132601711
4-[(6-chloro-3-pyridinyl)methyl]piperazine-2-carboxylic acid
CID 71649664

Frequently Asked Questions

What is the IUPAC name of (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol?
The IUPAC name of (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol (CID 130523883) is (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol.
What is the SMILES notation for (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol?
The canonical SMILES for (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol is O[C@H]1CON(Cc2ccc(Cl)nc2)C1.
What is the InChIKey of (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol?
The InChIKey is FEXMRFNOSUAHJR-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H11ClN2O2/c10-9-2-1-7(3-11-9)4-12-5-8(13)6-14-12/h1-3,8,13H,4-6H2/t8-/m1/s1.
What are the key properties of (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol?
(4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol has a molecular weight of 214.65 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[(6-chloro-3-pyridinyl)methyl]-1,2-oxazolidin-4-ol is sourced from PubChem (CID 130523883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).