cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone

C22H30N2O2 — CID 134787285

IUPACcyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
SMILESO=C(C1CCCC1)N1CC2(CCCCN2C2COC2)Cc2ccccc21
InChIInChI=1S/C22H30N2O2/c25-21(17-7-1-2-8-17)23-16-22(13-18-9-3-4-10-20(18)23)11-5-6-12-24(22)19-14-26-15-19/h3-4,9-10,17,19H,1-2,5-8,11-16H2
InChIKeyZEQMVDFYMNLNEL-UHFFFAOYSA-N
MW354.49 g/mol
LogP3.39
Rot. Bonds2

About cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone

cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone (PubChem CID 134787285) has the molecular formula C22H30N2O2 and a molecular weight of 354.49 g/mol. Its IUPAC name is cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
PubChem CID134787285
Molecular FormulaC22H30N2O2
Molecular Weight354.49 g/mol
Exact Mass354.23
IUPAC Namecyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
SMILESO=C(C1CCCC1)N1CC2(CCCCN2C2COC2)Cc2ccccc21
InChIInChI=1S/C22H30N2O2/c25-21(17-7-1-2-8-17)23-16-22(13-18-9-3-4-10-20(18)23)11-5-6-12-24(22)19-14-26-15-19/h3-4,9-10,17,19H,1-2,5-8,11-16H2
InChIKeyZEQMVDFYMNLNEL-UHFFFAOYSA-N
XLogP3.39
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.49
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl-[1'-(pyridin-3-ylmethyl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
CID 134789983
cyclopentyl(spiro[2,5-dihydro-4,1-benzoxazepine-3,3'-pyrrolidine]-1-yl)methanone
CID 118740488
cyclopentyl-[1'-(cyclopropylmethyl)spiro[2,4-dihydroquinoline-3,3'-piperidine]-1-yl]methanone
CID 134788894
[1'-(cyclohexylmethyl)spiro[2,4-dihydroquinoline-3,3'-piperidine]-1-yl]-cyclopentylmethanone
CID 134788181
4-[1-(cyclopentanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-pyrrolidine]-1'-yl]-4-oxobutanoic acid
CID 134791170
1-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,4'-piperidine]-1-yl]ethanone
CID 134788666
[1'-[(4-chlorophenyl)methyl]spiro[2,5-dihydro-4,1-benzoxazepine-3,3'-pyrrolidine]-1-yl]-cyclopentylmethanone
CID 134789733
1-(cyclobutanecarbonyl)-5-cyclopentyl-3,6-dihydro-2H-1,5-benzodiazocin-4-one
CID 134786724
3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
CID 71879683
cyclopentyl-(2,2-dimethyl-3H-1,4-benzoxazin-4-yl)methanone
CID 167969671
3,4-dihydro-2H-quinolin-1-yl-(1,1-dioxothian-3-yl)methanone
CID 110857121
cycloheptyl(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)methanone;hydrochloride
CID 119521255

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone?
The IUPAC name of cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone (CID 134787285) is cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone?
The canonical SMILES for cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone is O=C(C1CCCC1)N1CC2(CCCCN2C2COC2)Cc2ccccc21.
What is the InChIKey of cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone?
The InChIKey is ZEQMVDFYMNLNEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O2/c25-21(17-7-1-2-8-17)23-16-22(13-18-9-3-4-10-20(18)23)11-5-6-12-24(22)19-14-26-15-19/h3-4,9-10,17,19H,1-2,5-8,11-16H2.
What are the key properties of cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone?
cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone has a molecular weight of 354.49 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone is sourced from PubChem (CID 134787285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).