(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one

C15H14FN7O2 — CID 69365238

IUPAC(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one
SMILESCc1cn(-c2ccc(N3C[C@H](Cn4ncnn4)OC3=O)cc2F)cn1
InChIInChI=1S/C15H14FN7O2/c1-10-5-21(9-17-10)14-3-2-11(4-13(14)16)22-6-12(25-15(22)24)7-23-19-8-18-20-23/h2-5,8-9,12H,6-7H2,1H3/t12-/m1/s1
InChIKeyUHYWWQJUQBMCHG-GFCCVEGCSA-N
MW343.32 g/mol
LogP1.33
Rot. Bonds4

About (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one

(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one (PubChem CID 69365238) has the molecular formula C15H14FN7O2 and a molecular weight of 343.32 g/mol. Its IUPAC name is (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one
PubChem CID69365238
Molecular FormulaC15H14FN7O2
Molecular Weight343.32 g/mol
Exact Mass343.12
IUPAC Name(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one
SMILESCc1cn(-c2ccc(N3C[C@H](Cn4ncnn4)OC3=O)cc2F)cn1
InChIInChI=1S/C15H14FN7O2/c1-10-5-21(9-17-10)14-3-2-11(4-13(14)16)22-6-12(25-15(22)24)7-23-19-8-18-20-23/h2-5,8-9,12H,6-7H2,1H3/t12-/m1/s1
InChIKeyUHYWWQJUQBMCHG-GFCCVEGCSA-N
XLogP1.33
TPSA90.96 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.32
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

3-[3-fluoro-4-(2-thia-6-azaspiro[3.3]heptan-6-yl)phenyl]-5-(triazol-2-ylmethyl)-1,3-oxazolidin-2-one
CID 135148294
(5R)-3-[3-fluoro-4-[3-(5-trimethylsilyl-1,2-oxazol-3-yl)pyrrol-1-yl]phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
CID 25049886
N-[[(5S)-3-[3-fluoro-4-[4-(1,2,4-triazol-1-ylmethyl)imidazol-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide
CID 25119487
(5R)-5-(azidomethyl)-3-[4-[4-(chloromethyl)imidazol-1-yl]-3-fluorophenyl]-1,3-oxazolidin-2-one
CID 59591365
N-[[(5S)-3-[4-(4-cyanoimidazol-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10497540
N-[[3-[4-(4-ethynylimidazol-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 21255482
3-[3-fluoro-4-(3-methyl-1,2,4-triazol-1-yl)phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 76556203
(5R)-5-(azidomethyl)-3-[3-fluoro-4-[4-(1,2,4-triazol-1-ylmethyl)imidazol-1-yl]phenyl]-1,3-oxazolidin-2-one
CID 25121946
(5R)-3-(3-fluoro-4-piperazin-1-ylphenyl)-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one;dihydrochloride
CID 69364107
[(5R)-3-[3-fluoro-4-[4-[(E)-hydroxyiminomethyl]imidazol-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methylimino-iminoazanium
CID 142276605
1-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-N-(4-methyl-6-oxo-1H-pyrimidin-2-yl)imidazole-4-carboxamide
CID 135682114
3-[3-fluoro-4-(triazol-1-yl)phenyl]-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
CID 154456896

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one (CID 69365238) is (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one is Cc1cn(-c2ccc(N3C[C@H](Cn4ncnn4)OC3=O)cc2F)cn1.
What is the InChIKey of (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one?
The InChIKey is UHYWWQJUQBMCHG-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H14FN7O2/c1-10-5-21(9-17-10)14-3-2-11(4-13(14)16)22-6-12(25-15(22)24)7-23-19-8-18-20-23/h2-5,8-9,12H,6-7H2,1H3/t12-/m1/s1.
What are the key properties of (5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one?
(5R)-3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one has a molecular weight of 343.32 g/mol, XLogP of 1.33, 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-(4-methylimidazol-1-yl)phenyl]-5-(tetrazol-2-ylmethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 69365238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).