4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one

C31H29GeNO2 — CID 164684507

IUPAC4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one
SMILESCC1(C)COC(=O)N1C=C(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H29GeNO2/c1-31(2)24-35-30(34)33(31)23-29(25-15-7-3-8-16-25)32(26-17-9-4-10-18-26,27-19-11-5-12-20-27)28-21-13-6-14-22-28/h3-23H,24H2,1-2H3
InChIKeyYTUSNXQNUNFGGA-UHFFFAOYSA-N
MW520.19 g/mol
LogP4.97
Rot. Bonds6

About 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one

4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one (PubChem CID 164684507) has the molecular formula C31H29GeNO2 and a molecular weight of 520.19 g/mol. Its IUPAC name is 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one
PubChem CID164684507
Molecular FormulaC31H29GeNO2
Molecular Weight520.19 g/mol
Exact Mass521.14
IUPAC Name4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one
SMILESCC1(C)COC(=O)N1C=C(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H29GeNO2/c1-31(2)24-35-30(34)33(31)23-29(25-15-7-3-8-16-25)32(26-17-9-4-10-18-26,27-19-11-5-12-20-27)28-21-13-6-14-22-28/h3-23H,24H2,1-2H3
InChIKeyYTUSNXQNUNFGGA-UHFFFAOYSA-N
XLogP4.97
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500520.19
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(E)-2-[4-(trifluoromethyl)phenyl]-1-triphenylgermylethenyl]-1,3-oxazolidin-2-one
CID 168336468
3-[(Z)-2-phenyl-2-triphenylsilylethenyl]-1,3-oxazolidin-2-one
CID 138978331
(4S)-3-[(Z,3R)-2,3-diphenylbut-1-enyl]-4-propan-2-yl-1,3-oxazolidin-2-one
CID 101348788
3-[(Z)-[(2S,5R)-5-methyl-2-phenylcyclohex-3-en-1-ylidene]methyl]-1,3-oxazolidin-2-one
CID 125508766
3-[(E)-2-[dimethyl(phenyl)silyl]-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 132504006
3-[(Z)-1-chloro-2,3,3-triphenylprop-1-enyl]-1,3-oxazolidin-2-one
CID 132605301
3-[(Z)-[(2S)-3-methyl-2-phenylcyclohex-3-en-1-ylidene]methyl]-1,3-oxazolidin-2-one
CID 134946570
3-[(Z)-[(2S,6R)-3,6-dimethyl-2-phenylcyclohex-3-en-1-ylidene]methyl]-1,3-oxazolidin-2-one
CID 134946571
3-[(Z)-[(2S,5R)-2,5-diphenylcyclohex-3-en-1-ylidene]methyl]-1,3-oxazolidin-2-one
CID 135061677
3-[(Z)-[(2S,5S,6R)-5,6-dimethyl-2-phenylcyclohex-3-en-1-ylidene]methyl]-1,3-oxazolidin-2-one
CID 135062837
(4R)-4-methyl-3-[(3R)-3-phenyl-2-[(1S)-1-phenylethyl]but-1-enyl]-1,3-oxazolidin-2-one
CID 139037663
(4S)-3-[(E,3R)-2,3-diphenylbut-1-enyl]-4-methyl-1,3-oxazolidin-2-one;(4S)-3-[(E,3S)-2,3-diphenylbut-1-enyl]-4-methyl-1,3-oxazolidin-2-one
CID 139043349

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one (CID 164684507) is 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one is CC1(C)COC(=O)N1C=C(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one?
The InChIKey is YTUSNXQNUNFGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29GeNO2/c1-31(2)24-35-30(34)33(31)23-29(25-15-7-3-8-16-25)32(26-17-9-4-10-18-26,27-19-11-5-12-20-27)28-21-13-6-14-22-28/h3-23H,24H2,1-2H3.
What are the key properties of 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one?
4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one has a molecular weight of 520.19 g/mol, XLogP of 4.97, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-3-(2-phenyl-2-triphenylgermylethenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 164684507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).