5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide

C24H24ClN3O5S — CID 25143973

About 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide

5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide (PubChem CID 25143973) has the molecular formula C24H24ClN3O5S and a molecular weight of 501.99 g/mol. Its IUPAC name is 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide.

Molecular Properties

• Compound Name: 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
• PubChem CID: 25143973
• Molecular Formula: C24H24ClN3O5S
• Molecular Weight: 501.99 g/mol
• Exact Mass: 501.11
• IUPAC Name: 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
• SMILES: Cc1cc(N2C[C@H](CNC(=O)c3ccc(Cl)s3)OC2=O)cc(C)c1-n1cccc(CCO)c1=O
• InChI: InChI=1S/C24H24ClN3O5S/c1-14-10-17(11-15(2)21(14)27-8-3-4-16(7-9-29)23(27)31)28-13-18(33-24(28)32)12-26-22(30)19-5-6-20(25)34-19/h3-6,8,10-11,18,29H,7,9,12-13H2,1-2H3,(H,26,30)/t18-/m0/s1
• InChIKey: NFJJPEVXYLMUSC-SFHVURJKSA-N
• XLogP: 3.46
• TPSA: 100.87 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	501.99
LogP ≤ 5	3.46
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?

The IUPAC name of 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide (CID 25143973) is 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide.

What is the SMILES notation for 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?

The canonical SMILES for 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide is Cc1cc(N2C[C@H](CNC(=O)c3ccc(Cl)s3)OC2=O)cc(C)c1-n1cccc(CCO)c1=O.

What is the InChIKey of 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?

The InChIKey is NFJJPEVXYLMUSC-SFHVURJKSA-N. The full InChI is InChI=1S/C24H24ClN3O5S/c1-14-10-17(11-15(2)21(14)27-8-3-4-16(7-9-29)23(27)31)28-13-18(33-24(28)32)12-26-22(30)19-5-6-20(25)34-19/h3-6,8,10-11,18,29H,7,9,12-13H2,1-2H3,(H,26,30)/t18-/m0/s1.

What are the key properties of 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?

5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide has a molecular weight of 501.99 g/mol, XLogP of 3.46, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-N-[[(5S)-3-[4-[3-(2-hydroxyethyl)-2-oxo-1-pyridinyl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 25143973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).