N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide

C21H22N2O4 — CID 110409409

IUPACN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)cc1C(=O)NCC1CN(C2CC2)C(=O)O1
InChIInChI=1S/C21H22N2O4/c1-26-19-10-7-15(14-5-3-2-4-6-14)11-18(19)20(24)22-12-17-13-23(16-8-9-16)21(25)27-17/h2-7,10-11,16-17H,8-9,12-13H2,1H3,(H,22,24)
InChIKeyUFDHFUVMZYHJRL-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.08
Rot. Bonds6

About N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide

N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide (PubChem CID 110409409) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide.

Molecular Properties

Compound NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide
PubChem CID110409409
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC NameN-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)cc1C(=O)NCC1CN(C2CC2)C(=O)O1
InChIInChI=1S/C21H22N2O4/c1-26-19-10-7-15(14-5-3-2-4-6-14)11-18(19)20(24)22-12-17-13-23(16-8-9-16)21(25)27-17/h2-7,10-11,16-17H,8-9,12-13H2,1H3,(H,22,24)
InChIKeyUFDHFUVMZYHJRL-UHFFFAOYSA-N
XLogP3.08
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzamide
CID 110315613
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-4-methoxy-3-methylsulfonylbenzamide
CID 110634107
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-3-methoxybenzamide
CID 110315564
2-methoxy-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 16920424
N-cyclopropyl-2-methoxy-5-phenylbenzamide
CID 110406431
4-tert-butyl-N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110315571
3,4-dimethoxy-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 16920432
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
N-[[3-(3-chloro-4-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-fluorobenzamide
CID 110328338
N-(4-acetamidobutyl)-2-methoxy-5-phenylbenzamide
CID 110609817
N-(3-acetamidopropyl)-2-methoxy-5-phenylbenzamide
CID 110630734
N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide
CID 110408034

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide?
The IUPAC name of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide (CID 110409409) is N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide.
What is the SMILES notation for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide?
The canonical SMILES for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide is COc1ccc(-c2ccccc2)cc1C(=O)NCC1CN(C2CC2)C(=O)O1.
What is the InChIKey of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide?
The InChIKey is UFDHFUVMZYHJRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-26-19-10-7-15(14-5-3-2-4-6-14)11-18(19)20(24)22-12-17-13-23(16-8-9-16)21(25)27-17/h2-7,10-11,16-17H,8-9,12-13H2,1H3,(H,22,24).
What are the key properties of N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide?
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide has a molecular weight of 366.42 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-2-methoxy-5-phenylbenzamide is sourced from PubChem (CID 110409409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).