cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone

C15H26N2O2 — CID 97396261

IUPACcyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone
SMILESCCN1CCOCC12CCN(C(=O)C1CCC1)CC2
InChIInChI=1S/C15H26N2O2/c1-2-17-10-11-19-12-15(17)6-8-16(9-7-15)14(18)13-4-3-5-13/h13H,2-12H2,1H3
InChIKeyBQHQOGYGHDTCEV-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.50
Rot. Bonds2

About cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone

cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone (PubChem CID 97396261) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone
PubChem CID97396261
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Namecyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone
SMILESCCN1CCOCC12CCN(C(=O)C1CCC1)CC2
InChIInChI=1S/C15H26N2O2/c1-2-17-10-11-19-12-15(17)6-8-16(9-7-15)14(18)13-4-3-5-13/h13H,2-12H2,1H3
InChIKeyBQHQOGYGHDTCEV-UHFFFAOYSA-N
XLogP1.50
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone?
The IUPAC name of cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone (CID 97396261) is cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone.
What is the SMILES notation for cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone?
The canonical SMILES for cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone is CCN1CCOCC12CCN(C(=O)C1CCC1)CC2.
What is the InChIKey of cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone?
The InChIKey is BQHQOGYGHDTCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-2-17-10-11-19-12-15(17)6-8-16(9-7-15)14(18)13-4-3-5-13/h13H,2-12H2,1H3.
What are the key properties of cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone?
cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone has a molecular weight of 266.38 g/mol, XLogP of 1.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone is sourced from PubChem (CID 97396261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).