N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide

C20H23N3O5 — CID 110634079

IUPACN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
SMILESCOc1ccc(-c2nc(CC(=O)NCC3CN(C4CC4)C(=O)O3)c(C)o2)cc1
InChIInChI=1S/C20H23N3O5/c1-12-17(22-19(27-12)13-3-7-15(26-2)8-4-13)9-18(24)21-10-16-11-23(14-5-6-14)20(25)28-16/h3-4,7-8,14,16H,5-6,9-11H2,1-2H3,(H,21,24)
InChIKeyMJNDRUPIKRAYEJ-UHFFFAOYSA-N
MW385.42 g/mol
LogP2.30
Rot. Bonds7

About N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide

N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide (PubChem CID 110634079) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide.

Molecular Properties

Compound NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
PubChem CID110634079
Molecular FormulaC20H23N3O5
Molecular Weight385.42 g/mol
Exact Mass385.16
IUPAC NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
SMILESCOc1ccc(-c2nc(CC(=O)NCC3CN(C4CC4)C(=O)O3)c(C)o2)cc1
InChIInChI=1S/C20H23N3O5/c1-12-17(22-19(27-12)13-3-7-15(26-2)8-4-13)9-18(24)21-10-16-11-23(14-5-6-14)20(25)28-16/h3-4,7-8,14,16H,5-6,9-11H2,1-2H3,(H,21,24)
InChIKeyMJNDRUPIKRAYEJ-UHFFFAOYSA-N
XLogP2.30
TPSA93.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(cyclopentylmethyl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
CID 110627528
2-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 110371730
N-[3-(4-hydroxyphenyl)propyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110424249
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide
CID 110409409
2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfinyl]-N-(oxolan-2-ylmethyl)acetamide
CID 5307709
2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfonyl]-N-(oxolan-2-ylmethyl)acetamide
CID 20860705
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-4-(2-methylphenyl)butanamide
CID 110634144
N-(3,4-dimethoxyphenyl)-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110371709
4-tert-butyl-N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110315571
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 51336962
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110371720
N-[(2-hydroxycyclopentyl)methyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 111464140

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide (CID 110634079) is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide.
What is the SMILES notation for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The canonical SMILES for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide is COc1ccc(-c2nc(CC(=O)NCC3CN(C4CC4)C(=O)O3)c(C)o2)cc1.
What is the InChIKey of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The InChIKey is MJNDRUPIKRAYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-12-17(22-19(27-12)13-3-7-15(26-2)8-4-13)9-18(24)21-10-16-11-23(14-5-6-14)20(25)28-16/h3-4,7-8,14,16H,5-6,9-11H2,1-2H3,(H,21,24).
What are the key properties of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide has a molecular weight of 385.42 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide is sourced from PubChem (CID 110634079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).