2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide

C27H24F2N2O3 — CID 10863520

IUPAC2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide
SMILESCN(C)C(=O)C(F)(F)C[C@@H]1COC(=O)N1C1(c2ccccc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C27H24F2N2O3/c1-30(2)24(32)26(28,29)16-19-17-34-25(33)31(19)27(18-10-4-3-5-11-18)22-14-8-6-12-20(22)21-13-7-9-15-23(21)27/h3-15,19H,16-17H2,1-2H3/t19-/m1/s1
InChIKeyNNHVXCXHHDEEGV-LJQANCHMSA-N
MW462.50 g/mol
LogP4.89
Rot. Bonds5

About 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide

2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide (PubChem CID 10863520) has the molecular formula C27H24F2N2O3 and a molecular weight of 462.50 g/mol. Its IUPAC name is 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide.

Molecular Properties

Compound Name2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide
PubChem CID10863520
Molecular FormulaC27H24F2N2O3
Molecular Weight462.50 g/mol
Exact Mass462.18
IUPAC Name2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide
SMILESCN(C)C(=O)C(F)(F)C[C@@H]1COC(=O)N1C1(c2ccccc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C27H24F2N2O3/c1-30(2)24(32)26(28,29)16-19-17-34-25(33)31(19)27(18-10-4-3-5-11-18)22-14-8-6-12-20(22)21-13-7-9-15-23(21)27/h3-15,19H,16-17H2,1-2H3/t19-/m1/s1
InChIKeyNNHVXCXHHDEEGV-LJQANCHMSA-N
XLogP4.89
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.50
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide?
The IUPAC name of 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide (CID 10863520) is 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide.
What is the SMILES notation for 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide?
The canonical SMILES for 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide is CN(C)C(=O)C(F)(F)C[C@@H]1COC(=O)N1C1(c2ccccc2)c2ccccc2-c2ccccc21.
What is the InChIKey of 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide?
The InChIKey is NNHVXCXHHDEEGV-LJQANCHMSA-N. The full InChI is InChI=1S/C27H24F2N2O3/c1-30(2)24(32)26(28,29)16-19-17-34-25(33)31(19)27(18-10-4-3-5-11-18)22-14-8-6-12-20(22)21-13-7-9-15-23(21)27/h3-15,19H,16-17H2,1-2H3/t19-/m1/s1.
What are the key properties of 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide?
2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide has a molecular weight of 462.50 g/mol, XLogP of 4.89, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N,N-dimethyl-3-[(4R)-2-oxo-3-(9-phenylfluoren-9-yl)-1,3-oxazolidin-4-yl]propanamide is sourced from PubChem (CID 10863520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).