(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one

C19H19FN4O4 — CID 56929782

IUPAC(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
SMILESCN1CCN(c2ccc(-c3ccc(N4C[C@H](CO)OC4=O)cc3F)cn2)C1=O
InChIInChI=1S/C19H19FN4O4/c1-22-6-7-23(18(22)26)17-5-2-12(9-21-17)15-4-3-13(8-16(15)20)24-10-14(11-25)28-19(24)27/h2-5,8-9,14,25H,6-7,10-11H2,1H3/t14-/m1/s1
InChIKeyVJGXZAOIRFLSRZ-CQSZACIVSA-N
MW386.38 g/mol
LogP2.08
Rot. Bonds4

About (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one

(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one (PubChem CID 56929782) has the molecular formula C19H19FN4O4 and a molecular weight of 386.38 g/mol. Its IUPAC name is (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
PubChem CID56929782
Molecular FormulaC19H19FN4O4
Molecular Weight386.38 g/mol
Exact Mass386.14
IUPAC Name(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
SMILESCN1CCN(c2ccc(-c3ccc(N4C[C@H](CO)OC4=O)cc3F)cn2)C1=O
InChIInChI=1S/C19H19FN4O4/c1-22-6-7-23(18(22)26)17-5-2-12(9-21-17)15-4-3-13(8-16(15)20)24-10-14(11-25)28-19(24)27/h2-5,8-9,14,25H,6-7,10-11H2,1H3/t14-/m1/s1
InChIKeyVJGXZAOIRFLSRZ-CQSZACIVSA-N
XLogP2.08
TPSA86.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 11234049
CID 11234049
CID 168292806
CID 168292806
CID 53493230
CID 53493230
CID 53493231
CID 53493231
CID 53493629
CID 53493629
CID 11303193
CID 11303193
CID 168271988
CID 168271988
CID 168275127
CID 168275127
CID 168276237
CID 168276237
CID 168288993
CID 168288993
CID 56924762
CID 56924762
CID 56928300
CID 56928300

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one (CID 56929782) is (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one is CN1CCN(c2ccc(-c3ccc(N4C[C@H](CO)OC4=O)cc3F)cn2)C1=O.
What is the InChIKey of (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one?
The InChIKey is VJGXZAOIRFLSRZ-CQSZACIVSA-N. The full InChI is InChI=1S/C19H19FN4O4/c1-22-6-7-23(18(22)26)17-5-2-12(9-21-17)15-4-3-13(8-16(15)20)24-10-14(11-25)28-19(24)27/h2-5,8-9,14,25H,6-7,10-11H2,1H3/t14-/m1/s1.
What are the key properties of (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one?
(5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one has a molecular weight of 386.38 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[3-fluoro-4-[6-(3-methyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 56929782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).