(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide

C24H26N4O5 — CID 97360732

IUPAC(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
SMILESCOc1ccc(CNC(=O)[C@H]2Cn3ccnc3C3(CCN(C(=O)c4ccco4)CC3)O2)cc1
InChIInChI=1S/C24H26N4O5/c1-31-18-6-4-17(5-7-18)15-26-21(29)20-16-28-13-10-25-23(28)24(33-20)8-11-27(12-9-24)22(30)19-3-2-14-32-19/h2-7,10,13-14,20H,8-9,11-12,15-16H2,1H3,(H,26,29)/t20-/m1/s1
InChIKeyZDLFSLGCZMTKRS-HXUWFJFHSA-N
MW450.50 g/mol
LogP2.33
Rot. Bonds5

About (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide

(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide (PubChem CID 97360732) has the molecular formula C24H26N4O5 and a molecular weight of 450.50 g/mol. Its IUPAC name is (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide.

Molecular Properties

Compound Name(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
PubChem CID97360732
Molecular FormulaC24H26N4O5
Molecular Weight450.50 g/mol
Exact Mass450.19
IUPAC Name(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
SMILESCOc1ccc(CNC(=O)[C@H]2Cn3ccnc3C3(CCN(C(=O)c4ccco4)CC3)O2)cc1
InChIInChI=1S/C24H26N4O5/c1-31-18-6-4-17(5-7-18)15-26-21(29)20-16-28-13-10-25-23(28)24(33-20)8-11-27(12-9-24)22(30)19-3-2-14-32-19/h2-7,10,13-14,20H,8-9,11-12,15-16H2,1H3,(H,26,29)/t20-/m1/s1
InChIKeyZDLFSLGCZMTKRS-HXUWFJFHSA-N
XLogP2.33
TPSA98.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.50
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide with MolForge

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Related Compounds

(6S)-N-[(4-methoxyphenyl)methyl]-1'-(6-methylpyridine-2-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97360746
(6S)-N-[(4-methoxyphenyl)methyl]-1'-(pyridine-3-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97360739
(6S)-N-[(4-methoxyphenyl)methyl]-1'-(pyrazine-2-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97360741
1'-[(4-methoxyphenyl)methyl]-N-(pyridin-4-ylmethyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 134077220
(6R)-N-[(3-methoxyphenyl)methyl]-1'-(1-methylpyrrole-2-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97360683
(6R)-N-[(3-methoxyphenyl)methyl]-1'-(thiophen-2-ylmethyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97360658
(6R)-N-benzyl-1'-(dimethylsulfamoyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97440222
1'-[(4-methoxyphenyl)methyl]-N-(2-morpholin-4-ylethyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 134077189
N-(2-methylpropyl)-1'-(pyridine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 131649874
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 37375142
(6S)-1'-(1-methylindole-3-carbonyl)-N-(2-methylpropyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
CID 97440284
1-N',1-N'-dimethyl-6-N-(2-methylpropyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1',6-dicarboxamide
CID 133136205

Frequently Asked Questions

What is the IUPAC name of (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The IUPAC name of (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide (CID 97360732) is (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide.
What is the SMILES notation for (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The canonical SMILES for (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide is COc1ccc(CNC(=O)[C@H]2Cn3ccnc3C3(CCN(C(=O)c4ccco4)CC3)O2)cc1.
What is the InChIKey of (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The InChIKey is ZDLFSLGCZMTKRS-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H26N4O5/c1-31-18-6-4-17(5-7-18)15-26-21(29)20-16-28-13-10-25-23(28)24(33-20)8-11-27(12-9-24)22(30)19-3-2-14-32-19/h2-7,10,13-14,20H,8-9,11-12,15-16H2,1H3,(H,26,29)/t20-/m1/s1.
What are the key properties of (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
(6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide has a molecular weight of 450.50 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1'-(furan-2-carbonyl)-N-[(4-methoxyphenyl)methyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide is sourced from PubChem (CID 97360732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).