N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

C19H17N3O5 — CID 10270301

IUPACN-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc(-n3c(=O)oc4ccccc43)cc2)C(=O)O1
InChIInChI=1S/C19H17N3O5/c1-12(23)20-10-15-11-21(18(24)26-15)13-6-8-14(9-7-13)22-16-4-2-3-5-17(16)27-19(22)25/h2-9,15H,10-11H2,1H3,(H,20,23)/t15-/m0/s1
InChIKeyRWNYNKUBRVZGDE-HNNXBMFYSA-N
MW367.36 g/mol
LogP2.05
Rot. Bonds4

About N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 10270301) has the molecular formula C19H17N3O5 and a molecular weight of 367.36 g/mol. Its IUPAC name is N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID10270301
Molecular FormulaC19H17N3O5
Molecular Weight367.36 g/mol
Exact Mass367.12
IUPAC NameN-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc(-n3c(=O)oc4ccccc43)cc2)C(=O)O1
InChIInChI=1S/C19H17N3O5/c1-12(23)20-10-15-11-21(18(24)26-15)13-6-8-14(9-7-13)22-16-4-2-3-5-17(16)27-19(22)25/h2-9,15H,10-11H2,1H3,(H,20,23)/t15-/m0/s1
InChIKeyRWNYNKUBRVZGDE-HNNXBMFYSA-N
XLogP2.05
TPSA93.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (CID 10270301) is N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NC[C@H]1CN(c2ccc(-n3c(=O)oc4ccccc43)cc2)C(=O)O1.
What is the InChIKey of N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is RWNYNKUBRVZGDE-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H17N3O5/c1-12(23)20-10-15-11-21(18(24)26-15)13-6-8-14(9-7-13)22-16-4-2-3-5-17(16)27-19(22)25/h2-9,15H,10-11H2,1H3,(H,20,23)/t15-/m0/s1.
What are the key properties of N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 367.36 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-benzoxazol-3-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 10270301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).