(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one

C19H16FN7O2 — CID 58239111

IUPAC(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
SMILESCc1nc2cc(-c3ccc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)ccn2n1
InChIInChI=1S/C19H16FN7O2/c1-12-22-18-8-13(4-6-27(18)23-12)16-3-2-14(9-17(16)20)26-11-15(29-19(26)28)10-25-7-5-21-24-25/h2-9,15H,10-11H2,1H3/t15-/m0/s1
InChIKeyMEVLWCYWPJEHHM-HNNXBMFYSA-N
MW393.38 g/mol
LogP2.46
Rot. Bonds4

About (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one

(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one (PubChem CID 58239111) has the molecular formula C19H16FN7O2 and a molecular weight of 393.38 g/mol. Its IUPAC name is (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
PubChem CID58239111
Molecular FormulaC19H16FN7O2
Molecular Weight393.38 g/mol
Exact Mass393.13
IUPAC Name(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
SMILESCc1nc2cc(-c3ccc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)ccn2n1
InChIInChI=1S/C19H16FN7O2/c1-12-22-18-8-13(4-6-27(18)23-12)16-3-2-14(9-17(16)20)26-11-15(29-19(26)28)10-25-7-5-21-24-25/h2-9,15H,10-11H2,1H3/t15-/m0/s1
InChIKeyMEVLWCYWPJEHHM-HNNXBMFYSA-N
XLogP2.46
TPSA90.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.38
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one with MolForge

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Related Compounds

CID 46188928
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CID 121333500
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CID 45274003
CID 45274003
CID 58386288
CID 58386288
CID 71471488
CID 71471488
CID 11016418
CID 11016418
CID 56645935
CID 56645935
CID 56645936
CID 56645936
CID 56645938
CID 56645938
CID 56645940
CID 56645940

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one (CID 58239111) is (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one is Cc1nc2cc(-c3ccc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)ccn2n1.
What is the InChIKey of (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one?
The InChIKey is MEVLWCYWPJEHHM-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H16FN7O2/c1-12-22-18-8-13(4-6-27(18)23-12)16-3-2-14(9-17(16)20)26-11-15(29-19(26)28)10-25-7-5-21-24-25/h2-9,15H,10-11H2,1H3/t15-/m0/s1.
What are the key properties of (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one?
(5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one has a molecular weight of 393.38 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[3-fluoro-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 58239111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).