RVIDXIHVAACTPD-ADKRDUOOSA-N

Name: RVIDXIHVAACTPD-ADKRDUOOSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₃₃H₂₇F₆N₅O₅ — CID 56968510

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC5-[3-[6-(azetidin-1-yl)-2-[[(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]-3-pyridinyl]-4-methoxyphenyl]pyrazine-2-carboxylic acid

SMILESCOc1ccc(-c2cnc(C(=O)O)cn2)cc1-c1ccc(N2CCC2)nc1CN1C(=O)O[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1C

InChIInChI=1S/C33H27F6N5O5/c1-17-29(19-10-20(32(34,35)36)13-21(11-19)33(37,38)39)49-31(47)44(17)16-26-22(5-7-28(42-26)43-8-3-9-43)23-12-18(4-6-27(23)48-2)24-14-41-25(15-40-24)30(45)46/h4-7,10-15,17,29H,3,8-9,16H2,1-2H3,(H,45,46)/t17-,29-/m0/s1

InChIKeyRVIDXIHVAACTPD-ADKRDUOOSA-N

MW687.60 g/mol

LogP7.24

Rot. Bonds8

About RVIDXIHVAACTPD-ADKRDUOOSA-N

RVIDXIHVAACTPD-ADKRDUOOSA-N (PubChem CID 56968510) has the molecular formula C₃₃H₂₇F₆N₅O₅ and a molecular weight of 687.60 g/mol. Its IUPAC name is 5-[3-[6-(azetidin-1-yl)-2-[[(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]-3-pyridinyl]-4-methoxyphenyl]pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name	RVIDXIHVAACTPD-ADKRDUOOSA-N
PubChem CID	56968510
Molecular Formula	C₃₃H₂₇F₆N₅O₅
Molecular Weight	687.60 g/mol
Exact Mass	687.19
IUPAC Name	5-[3-[6-(azetidin-1-yl)-2-[[(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]-3-pyridinyl]-4-methoxyphenyl]pyrazine-2-carboxylic acid
SMILES	COc1ccc(-c2cnc(C(=O)O)cn2)cc1-c1ccc(N2CCC2)nc1CN1C(=O)O[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1C
InChI	InChI=1S/C33H27F6N5O5/c1-17-29(19-10-20(32(34,35)36)13-21(11-19)33(37,38)39)49-31(47)44(17)16-26-22(5-7-28(42-26)43-8-3-9-43)23-12-18(4-6-27(23)48-2)24-14-41-25(15-40-24)30(45)46/h4-7,10-15,17,29H,3,8-9,16H2,1-2H3,(H,45,46)/t17-,29-/m0/s1
InChIKey	RVIDXIHVAACTPD-ADKRDUOOSA-N
XLogP	7.24
TPSA	117.98 Å²
H-Bond Donors	1
H-Bond Acceptors	8
Rotatable Bonds	8
Heavy Atoms	49
Complexity	—

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	687.60
LogP ≤ 5	7.24
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of RVIDXIHVAACTPD-ADKRDUOOSA-N?

The IUPAC name of RVIDXIHVAACTPD-ADKRDUOOSA-N (CID 56968510) is 5-[3-[6-(azetidin-1-yl)-2-[[(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]-3-pyridinyl]-4-methoxyphenyl]pyrazine-2-carboxylic acid.

What is the SMILES notation for RVIDXIHVAACTPD-ADKRDUOOSA-N?

The canonical SMILES for RVIDXIHVAACTPD-ADKRDUOOSA-N is COc1ccc(-c2cnc(C(=O)O)cn2)cc1-c1ccc(N2CCC2)nc1CN1C(=O)O[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1C.

What is the InChIKey of RVIDXIHVAACTPD-ADKRDUOOSA-N?

The InChIKey is RVIDXIHVAACTPD-ADKRDUOOSA-N. The full InChI is InChI=1S/C33H27F6N5O5/c1-17-29(19-10-20(32(34,35)36)13-21(11-19)33(37,38)39)49-31(47)44(17)16-26-22(5-7-28(42-26)43-8-3-9-43)23-12-18(4-6-27(23)48-2)24-14-41-25(15-40-24)30(45)46/h4-7,10-15,17,29H,3,8-9,16H2,1-2H3,(H,45,46)/t17-,29-/m0/s1.

What are the key properties of RVIDXIHVAACTPD-ADKRDUOOSA-N?

RVIDXIHVAACTPD-ADKRDUOOSA-N has a molecular weight of 687.60 g/mol, XLogP of 7.24, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for RVIDXIHVAACTPD-ADKRDUOOSA-N is sourced from PubChem (CID 56968510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 56968510 — identifiers, structure, computed properties (public domain)

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