N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate

C16H15N4O5- — CID 57371759

IUPACN-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate
SMILESCN(C[C@H]1CN(c2ccc3c(c2)OCc2nccn2-3)C(=O)O1)C(=O)[O-]
InChIInChI=1S/C16H16N4O5/c1-18(15(21)22)7-11-8-20(16(23)25-11)10-2-3-12-13(6-10)24-9-14-17-4-5-19(12)14/h2-6,11H,7-9H2,1H3,(H,21,22)/p-1/t11-/m0/s1
InChIKeyYFSBEZFGTBUNRN-NSHDSACASA-M
MW343.32 g/mol
LogP0.37
Rot. Bonds3

About N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate

N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate (PubChem CID 57371759) has the molecular formula C16H15N4O5- and a molecular weight of 343.32 g/mol. Its IUPAC name is N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate.

Molecular Properties

Compound NameN-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate
PubChem CID57371759
Molecular FormulaC16H15N4O5-
Molecular Weight343.32 g/mol
Exact Mass343.10
IUPAC NameN-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate
SMILESCN(C[C@H]1CN(c2ccc3c(c2)OCc2nccn2-3)C(=O)O1)C(=O)[O-]
InChIInChI=1S/C16H16N4O5/c1-18(15(21)22)7-11-8-20(16(23)25-11)10-2-3-12-13(6-10)24-9-14-17-4-5-19(12)14/h2-6,11H,7-9H2,1H3,(H,21,22)/p-1/t11-/m0/s1
InChIKeyYFSBEZFGTBUNRN-NSHDSACASA-M
XLogP0.37
TPSA99.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.32
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate with MolForge

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Launch Full Analysis

Related Compounds

N-[[3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylacetamide
CID 118689021
methyl-[[(5S)-3-(1-methyl-2-oxo-4,5-dihydro-3,1-benzoxazepin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamic acid
CID 68806114
N-[[(5S)-3-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-4H-imidazo[2,1-c][1,4]benzoxazin-7-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 70279145
N-[[(5S)-3-(4-ethyl-3-oxo-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57030886
methyl-[[(5S)-2-oxo-3-[4-(2-oxo-1,3-oxazolidin-3-yl)-3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl]methyl]carbamothioic S-acid
CID 21026141
(5R)-3-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 10149461
(5S)-3-[3-fluoro-4-(4-pyridin-2-ylpyrazol-1-yl)phenyl]-5-[[2-hydroxyethyl(methyl)amino]methyl]-1,3-oxazolidin-2-one
CID 127037766
N-[[3-(3-cyanoimino-4-methyl-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 85417223
(5S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 66736976
(5R)-3-(4-cyclopropyl-3-oxo-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 58746333
(5R)-3-(4-tert-butyl-3-oxo-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 58746383
N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 166269260

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate?
The IUPAC name of N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate (CID 57371759) is N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate.
What is the SMILES notation for N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate?
The canonical SMILES for N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate is CN(C[C@H]1CN(c2ccc3c(c2)OCc2nccn2-3)C(=O)O1)C(=O)[O-].
What is the InChIKey of N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate?
The InChIKey is YFSBEZFGTBUNRN-NSHDSACASA-M. The full InChI is InChI=1S/C16H16N4O5/c1-18(15(21)22)7-11-8-20(16(23)25-11)10-2-3-12-13(6-10)24-9-14-17-4-5-19(12)14/h2-6,11H,7-9H2,1H3,(H,21,22)/p-1/t11-/m0/s1.
What are the key properties of N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate?
N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate has a molecular weight of 343.32 g/mol, XLogP of 0.37, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-3-(4H-imidazo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-N-methylcarbamate is sourced from PubChem (CID 57371759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).