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

C22H23N3O3 — CID 162797942

IUPACN-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
SMILESCOc1ccc(-c2cn3c(n2)COC(CNC(=O)Cc2ccccc2)C3)cc1
InChIInChI=1S/C22H23N3O3/c1-27-18-9-7-17(8-10-18)20-14-25-13-19(28-15-21(25)24-20)12-23-22(26)11-16-5-3-2-4-6-16/h2-10,14,19H,11-13,15H2,1H3,(H,23,26)
InChIKeyJZBMJTBLPBLXHP-UHFFFAOYSA-N
MW377.44 g/mol
LogP2.82
Rot. Bonds6

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

N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide (PubChem CID 162797942) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
PubChem CID162797942
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
SMILESCOc1ccc(-c2cn3c(n2)COC(CNC(=O)Cc2ccccc2)C3)cc1
InChIInChI=1S/C22H23N3O3/c1-27-18-9-7-17(8-10-18)20-14-25-13-19(28-15-21(25)24-20)12-23-22(26)11-16-5-3-2-4-6-16/h2-10,14,19H,11-13,15H2,1H3,(H,23,26)
InChIKeyJZBMJTBLPBLXHP-UHFFFAOYSA-N
XLogP2.82
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide?
The IUPAC name of N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide (CID 162797942) is N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide.
What is the SMILES notation for N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide?
The canonical SMILES for N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide is COc1ccc(-c2cn3c(n2)COC(CNC(=O)Cc2ccccc2)C3)cc1.
What is the InChIKey of N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide?
The InChIKey is JZBMJTBLPBLXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-27-18-9-7-17(8-10-18)20-14-25-13-19(28-15-21(25)24-20)12-23-22(26)11-16-5-3-2-4-6-16/h2-10,14,19H,11-13,15H2,1H3,(H,23,26).
What are the key properties of N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide?
N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide has a molecular weight of 377.44 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide is sourced from PubChem (CID 162797942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).