N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide

C24H28GeN2O5 — CID 148782194

IUPACN-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(C(C(=O)Cc2ccc([Ge](C)(C)C)cc2)N(C)C(=O)c2cc(=O)[nH]o2)cc1
InChIInChI=1S/C24H28GeN2O5/c1-25(2,3)18-10-6-16(7-11-18)14-20(28)23(17-8-12-19(31-5)13-9-17)27(4)24(30)21-15-22(29)26-32-21/h6-13,15,23H,14H2,1-5H3,(H,26,29)
InChIKeyOKNGRXGRQJXMAV-UHFFFAOYSA-N
MW497.11 g/mol
LogP3.15
Rot. Bonds8

About N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide

N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide (PubChem CID 148782194) has the molecular formula C24H28GeN2O5 and a molecular weight of 497.11 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
PubChem CID148782194
Molecular FormulaC24H28GeN2O5
Molecular Weight497.11 g/mol
Exact Mass498.12
IUPAC NameN-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(C(C(=O)Cc2ccc([Ge](C)(C)C)cc2)N(C)C(=O)c2cc(=O)[nH]o2)cc1
InChIInChI=1S/C24H28GeN2O5/c1-25(2,3)18-10-6-16(7-11-18)14-20(28)23(17-8-12-19(31-5)13-9-17)27(4)24(30)21-15-22(29)26-32-21/h6-13,15,23H,14H2,1-5H3,(H,26,29)
InChIKeyOKNGRXGRQJXMAV-UHFFFAOYSA-N
XLogP3.15
TPSA92.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.11
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide (CID 148782194) is N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide is COc1ccc(C(C(=O)Cc2ccc([Ge](C)(C)C)cc2)N(C)C(=O)c2cc(=O)[nH]o2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The InChIKey is OKNGRXGRQJXMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28GeN2O5/c1-25(2,3)18-10-6-16(7-11-18)14-20(28)23(17-8-12-19(31-5)13-9-17)27(4)24(30)21-15-22(29)26-32-21/h6-13,15,23H,14H2,1-5H3,(H,26,29).
What are the key properties of N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide has a molecular weight of 497.11 g/mol, XLogP of 3.15, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)-2-oxo-3-(4-trimethylgermylphenyl)propyl]-N-methyl-3-oxo-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 148782194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).