N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

C18H24N2O5 — CID 72849328

IUPACN-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCOc1ccc(CN(CC2CCCO2)C(=O)CN2CCOC2=O)cc1
InChIInChI=1S/C18H24N2O5/c1-23-15-6-4-14(5-7-15)11-20(12-16-3-2-9-24-16)17(21)13-19-8-10-25-18(19)22/h4-7,16H,2-3,8-13H2,1H3
InChIKeyPKUPHWWNTCIUEF-UHFFFAOYSA-N
MW348.40 g/mol
LogP1.65
Rot. Bonds7

About N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (PubChem CID 72849328) has the molecular formula C18H24N2O5 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
PubChem CID72849328
Molecular FormulaC18H24N2O5
Molecular Weight348.40 g/mol
Exact Mass348.17
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCOc1ccc(CN(CC2CCCO2)C(=O)CN2CCOC2=O)cc1
InChIInChI=1S/C18H24N2O5/c1-23-15-6-4-14(5-7-15)11-20(12-16-3-2-9-24-16)17(21)13-19-8-10-25-18(19)22/h4-7,16H,2-3,8-13H2,1H3
InChIKeyPKUPHWWNTCIUEF-UHFFFAOYSA-N
XLogP1.65
TPSA68.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (CID 72849328) is N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is COc1ccc(CN(CC2CCCO2)C(=O)CN2CCOC2=O)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The InChIKey is PKUPHWWNTCIUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O5/c1-23-15-6-4-14(5-7-15)11-20(12-16-3-2-9-24-16)17(21)13-19-8-10-25-18(19)22/h4-7,16H,2-3,8-13H2,1H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide has a molecular weight of 348.40 g/mol, XLogP of 1.65, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is sourced from PubChem (CID 72849328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).