[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone

C23H27N3O2 — CID 134078028

IUPAC[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone
SMILESO=C(c1cccnc1)N1CCC2(CC1)CN(CC1CCOC1)c1ccccc12
InChIInChI=1S/C23H27N3O2/c27-22(19-4-3-10-24-14-19)25-11-8-23(9-12-25)17-26(15-18-7-13-28-16-18)21-6-2-1-5-20(21)23/h1-6,10,14,18H,7-9,11-13,15-17H2
InChIKeyWETOPKGSROZMET-UHFFFAOYSA-N
MW377.49 g/mol
LogP3.11
Rot. Bonds3

About [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone

[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone (PubChem CID 134078028) has the molecular formula C23H27N3O2 and a molecular weight of 377.49 g/mol. Its IUPAC name is [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone.

Molecular Properties

Compound Name[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone
PubChem CID134078028
Molecular FormulaC23H27N3O2
Molecular Weight377.49 g/mol
Exact Mass377.21
IUPAC Name[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone
SMILESO=C(c1cccnc1)N1CCC2(CC1)CN(CC1CCOC1)c1ccccc12
InChIInChI=1S/C23H27N3O2/c27-22(19-4-3-10-24-14-19)25-11-8-23(9-12-25)17-26(15-18-7-13-28-16-18)21-6-2-1-5-20(21)23/h1-6,10,14,18H,7-9,11-13,15-17H2
InChIKeyWETOPKGSROZMET-UHFFFAOYSA-N
XLogP3.11
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone with MolForge

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Related Compounds

[2-(oxolan-3-ylmethyl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone
CID 131639584
7-(cyclohexylmethyl)-2-(pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 45220503
[2-(cyclopropylmethyl)-1,1-dioxospiro[1,2-benzothiazole-3,3'-pyrrolidine]-1'-yl]-pyridin-3-ylmethanone
CID 131649120
1-morpholin-4-yl-2-[1'-(pyridine-3-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanone
CID 131642800
(4-fluoropiperidin-1-yl)-pyridin-3-ylmethanone
CID 150696190
N-cyclopropyl-2-[1'-(pyridine-3-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131662358
1'-(pyridine-3-carbonyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 97375619
3-methyl-1-(pyridine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 63142817
1-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)-2-[(3R)-oxolan-3-yl]ethanone
CID 126441295
[8-(cyclopropylmethyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]-pyridin-3-ylmethanone
CID 134072870
(4-benzylpiperidin-1-yl)-pyridin-3-ylmethanone
CID 669081
6-(pyridine-3-carbonyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119137379

Frequently Asked Questions

What is the IUPAC name of [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone?
The IUPAC name of [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone (CID 134078028) is [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone.
What is the SMILES notation for [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone?
The canonical SMILES for [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone is O=C(c1cccnc1)N1CCC2(CC1)CN(CC1CCOC1)c1ccccc12.
What is the InChIKey of [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone?
The InChIKey is WETOPKGSROZMET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O2/c27-22(19-4-3-10-24-14-19)25-11-8-23(9-12-25)17-26(15-18-7-13-28-16-18)21-6-2-1-5-20(21)23/h1-6,10,14,18H,7-9,11-13,15-17H2.
What are the key properties of [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone?
[1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone has a molecular weight of 377.49 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxolan-3-ylmethyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]-pyridin-3-ylmethanone is sourced from PubChem (CID 134078028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).