2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide

C22H23N3O4 — CID 75411264

IUPAC2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide
SMILESCOc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)c2ccccc2OC)C3)cc1
InChIInChI=1S/C22H23N3O4/c1-27-16-9-7-15(8-10-16)19-13-25-12-17(29-14-21(25)24-19)11-23-22(26)18-5-3-4-6-20(18)28-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26)/t17-/m0/s1
InChIKeyKJGPJTNCIPNVIT-KRWDZBQOSA-N
MW393.44 g/mol
LogP2.90
Rot. Bonds6

About 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide

2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide (PubChem CID 75411264) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide
PubChem CID75411264
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC Name2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide
SMILESCOc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)c2ccccc2OC)C3)cc1
InChIInChI=1S/C22H23N3O4/c1-27-16-9-7-15(8-10-16)19-13-25-12-17(29-14-21(25)24-19)11-23-22(26)18-5-3-4-6-20(18)28-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26)/t17-/m0/s1
InChIKeyKJGPJTNCIPNVIT-KRWDZBQOSA-N
XLogP2.90
TPSA74.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
CID 162797942
N-[[2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]acetamide
CID 162836771
N-[4-[[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methylamino]methyl]phenyl]acetamide
CID 75367354
2-methoxy-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367630
N-[[(6S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-4-fluorobenzamide
CID 75367283
2-methoxy-N-[[(3S)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 40876673
2-methoxy-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 16920424
N-[(1-methylindol-3-yl)methyl]-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methanamine
CID 162798839
4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide
CID 110710086
2-methoxy-N-[[(4S)-7-methyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazol-4-yl]methyl]benzamide
CID 75410842
2-methoxy-N-[(7-methyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazol-4-yl)methyl]benzamide
CID 163017950
N-[[(2S)-7-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methoxybenzamide
CID 92757198

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide?
The IUPAC name of 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide (CID 75411264) is 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide?
The canonical SMILES for 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide is COc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)c2ccccc2OC)C3)cc1.
What is the InChIKey of 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide?
The InChIKey is KJGPJTNCIPNVIT-KRWDZBQOSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-27-16-9-7-15(8-10-16)19-13-25-12-17(29-14-21(25)24-19)11-23-22(26)18-5-3-4-6-20(18)28-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26)/t17-/m0/s1.
What are the key properties of 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide?
2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide has a molecular weight of 393.44 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]benzamide is sourced from PubChem (CID 75411264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).