N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide

C23H26N2O4 — CID 16674264

IUPACN-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC3(CC2)CC(=O)c2cc(C)ccc2O3)cc1
InChIInChI=1S/C23H26N2O4/c1-16-3-8-21-19(13-16)20(26)14-23(29-21)9-11-25(12-10-23)15-22(27)24-17-4-6-18(28-2)7-5-17/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,27)
InChIKeyCOGJPELWZIEAOD-UHFFFAOYSA-N
MW394.47 g/mol
LogP3.44
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide

N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide (PubChem CID 16674264) has the molecular formula C23H26N2O4 and a molecular weight of 394.47 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide
PubChem CID16674264
Molecular FormulaC23H26N2O4
Molecular Weight394.47 g/mol
Exact Mass394.19
IUPAC NameN-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC3(CC2)CC(=O)c2cc(C)ccc2O3)cc1
InChIInChI=1S/C23H26N2O4/c1-16-3-8-21-19(13-16)20(26)14-23(29-21)9-11-25(12-10-23)15-22(27)24-17-4-6-18(28-2)7-5-17/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,27)
InChIKeyCOGJPELWZIEAOD-UHFFFAOYSA-N
XLogP3.44
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 46958669
2-(4-hydroxy-4-methylpiperidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 80702513
butyl 6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate
CID 108734524
1'-butanoyl-6-methylspiro[3H-chromene-2,4'-piperidine]-4-one
CID 108734528
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(7-methoxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide
CID 46973216
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)acetamide
CID 863788
tert-butyl (2S)-6-methyl-4-oxospiro[3H-chromene-2,3'-pyrrolidine]-1'-carboxylate
CID 125451955
2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 2655698
6-methoxy-1'-[2-(3-methylphenoxy)acetyl]spiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 108746498
6-methoxy-1'-(3-methylbutanoyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 108758735
2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]-N-(4-methylphenyl)acetamide
CID 9259187
1'-[2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)acetyl]-6-methylspiro[3H-chromene-2,4'-piperidine]-4-one
CID 46960370

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide (CID 16674264) is N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide is COc1ccc(NC(=O)CN2CCC3(CC2)CC(=O)c2cc(C)ccc2O3)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide?
The InChIKey is COGJPELWZIEAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O4/c1-16-3-8-21-19(13-16)20(26)14-23(29-21)9-11-25(12-10-23)15-22(27)24-17-4-6-18(28-2)7-5-17/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,27).
What are the key properties of N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide?
N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide has a molecular weight of 394.47 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)acetamide is sourced from PubChem (CID 16674264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).