cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone

C19H32N2O4 — CID 172884685

IUPACcyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone
SMILESO=C(C1CCCC1)N1CCOC2(C1)CN(C1CCOCC1)CCCO2
InChIInChI=1S/C19H32N2O4/c22-18(16-4-1-2-5-16)21-9-13-25-19(15-21)14-20(8-3-10-24-19)17-6-11-23-12-7-17/h16-17H,1-15H2
InChIKeyHOUOMEUOKDWCMT-UHFFFAOYSA-N
MW352.48 g/mol
LogP1.63
Rot. Bonds2

About cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone

cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone (PubChem CID 172884685) has the molecular formula C19H32N2O4 and a molecular weight of 352.48 g/mol. Its IUPAC name is cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone
PubChem CID172884685
Molecular FormulaC19H32N2O4
Molecular Weight352.48 g/mol
Exact Mass352.24
IUPAC Namecyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone
SMILESO=C(C1CCCC1)N1CCOC2(C1)CN(C1CCOCC1)CCCO2
InChIInChI=1S/C19H32N2O4/c22-18(16-4-1-2-5-16)21-9-13-25-19(15-21)14-20(8-3-10-24-19)17-6-11-23-12-7-17/h16-17H,1-15H2
InChIKeyHOUOMEUOKDWCMT-UHFFFAOYSA-N
XLogP1.63
TPSA51.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone?
The IUPAC name of cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone (CID 172884685) is cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone.
What is the SMILES notation for cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone?
The canonical SMILES for cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone is O=C(C1CCCC1)N1CCOC2(C1)CN(C1CCOCC1)CCCO2.
What is the InChIKey of cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone?
The InChIKey is HOUOMEUOKDWCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O4/c22-18(16-4-1-2-5-16)21-9-13-25-19(15-21)14-20(8-3-10-24-19)17-6-11-23-12-7-17/h16-17H,1-15H2.
What are the key properties of cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone?
cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone has a molecular weight of 352.48 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[8-(oxan-4-yl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone is sourced from PubChem (CID 172884685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).