5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide

C23H23N3O3 — CID 135124838

IUPAC5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide
SMILESCOc1c(-c2ccc3c(c2)CC2(CCN(C(N)=O)CC2)O3)ccc2cccnc12
InChIInChI=1S/C23H23N3O3/c1-28-21-18(6-4-15-3-2-10-25-20(15)21)16-5-7-19-17(13-16)14-23(29-19)8-11-26(12-9-23)22(24)27/h2-7,10,13H,8-9,11-12,14H2,1H3,(H2,24,27)
InChIKeyHZLVDRXQJCLCTK-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.76
Rot. Bonds2

About 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide

5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide (PubChem CID 135124838) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide.

Molecular Properties

Compound Name5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide
PubChem CID135124838
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide
SMILESCOc1c(-c2ccc3c(c2)CC2(CCN(C(N)=O)CC2)O3)ccc2cccnc12
InChIInChI=1S/C23H23N3O3/c1-28-21-18(6-4-15-3-2-10-25-20(15)21)16-5-7-19-17(13-16)14-23(29-19)8-11-26(12-9-23)22(24)27/h2-7,10,13H,8-9,11-12,14H2,1H3,(H2,24,27)
InChIKeyHZLVDRXQJCLCTK-UHFFFAOYSA-N
XLogP3.76
TPSA77.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(8-methylquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine];dihydrochloride
CID 175982491
6-(8-methylquinolin-7-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carbaldehyde
CID 135141595
6-(1-methylbenzimidazol-5-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 135125440
6-(1H-indol-2-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 135126324
tert-butyl 3-(1'-carbamoylspiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl)indole-1-carboxylate
CID 135125222
6-methoxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylic acid
CID 67468525
[6-(8-chloroquinolin-7-yl)spiro[4H-1,3-benzodioxine-2,4'-piperidine]-1'-yl]-(oxolan-2-yl)methanone
CID 158936111
6-methoxy-1'-(thiophene-2-carbonyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 108735730
ethyl 6-quinolin-7-ylspiro[4H-1,3-benzodioxine-2,4'-piperidine]-1'-carboxylate
CID 135125393
N-ethoxy-6-(7-methylpyrazolo[1,5-a]pyridin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 135125282
1-(5-chlorospiro[3H-1-benzofuran-2,4'-piperidine]-1'-yl)-3-quinolin-8-yloxypropan-2-ol
CID 11316232
6-methoxy-1'-(2-phenoxyacetyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 44770200

Frequently Asked Questions

What is the IUPAC name of 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide?
The IUPAC name of 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide (CID 135124838) is 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide.
What is the SMILES notation for 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide?
The canonical SMILES for 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide is COc1c(-c2ccc3c(c2)CC2(CCN(C(N)=O)CC2)O3)ccc2cccnc12.
What is the InChIKey of 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide?
The InChIKey is HZLVDRXQJCLCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-28-21-18(6-4-15-3-2-10-25-20(15)21)16-5-7-19-17(13-16)14-23(29-19)8-11-26(12-9-23)22(24)27/h2-7,10,13H,8-9,11-12,14H2,1H3,(H2,24,27).
What are the key properties of 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide?
5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-methoxyquinolin-7-yl)spiro[3H-1-benzofuran-2,4'-piperidine]-1'-carboxamide is sourced from PubChem (CID 135124838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).