11-phenyl-1-oxa-4-azaspiro[5.5]undecane

C15H21NO — CID 105403743

IUPAC11-phenyl-1-oxa-4-azaspiro[5.5]undecane
SMILESc1ccc(C2CCCCC23CNCCO3)cc1
InChIInChI=1S/C15H21NO/c1-2-6-13(7-3-1)14-8-4-5-9-15(14)12-16-10-11-17-15/h1-3,6-7,14,16H,4-5,8-12H2
InChIKeySSSRUVUQHSPIMY-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.70
Rot. Bonds1

About 11-phenyl-1-oxa-4-azaspiro[5.5]undecane

11-phenyl-1-oxa-4-azaspiro[5.5]undecane (PubChem CID 105403743) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 11-phenyl-1-oxa-4-azaspiro[5.5]undecane.

Molecular Properties

Compound Name11-phenyl-1-oxa-4-azaspiro[5.5]undecane
PubChem CID105403743
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name11-phenyl-1-oxa-4-azaspiro[5.5]undecane
SMILESc1ccc(C2CCCCC23CNCCO3)cc1
InChIInChI=1S/C15H21NO/c1-2-6-13(7-3-1)14-8-4-5-9-15(14)12-16-10-11-17-15/h1-3,6-7,14,16H,4-5,8-12H2
InChIKeySSSRUVUQHSPIMY-UHFFFAOYSA-N
XLogP2.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5S,6S)-6-phenyl-1-azaspiro[4.5]decane
CID 97356341
6-phenyl-1,9-diazaspiro[4.5]decane
CID 91595107
5-(2-methylphenyl)-1-oxaspiro[3.5]nonane
CID 156803422
(4R)-3,3-difluoro-4-phenylpiperidine
CID 97032408
(2R,3S)-2-phenyl-5-azaspiro[2.4]heptane
CID 121315230
2-phenyl-5-azaspiro[2.4]heptane
CID 84654707
(1,2-diphenylcyclohexyl)silane
CID 175556330
1-[(9R)-9-phenylspiro[3.5]nonan-2-yl]piperazine
CID 171586794
7-phenyl-2-azaspiro[3.3]heptane
CID 121206984
2-fluoro-2-phenylmorpholine
CID 157082899
4-(1-amino-2-phenylcyclohexyl)aniline
CID 162690255
(5R,9R)-9-phenylmethoxy-1-oxa-7-azaspiro[4.4]nonane
CID 110160739

Frequently Asked Questions

What is the IUPAC name of 11-phenyl-1-oxa-4-azaspiro[5.5]undecane?
The IUPAC name of 11-phenyl-1-oxa-4-azaspiro[5.5]undecane (CID 105403743) is 11-phenyl-1-oxa-4-azaspiro[5.5]undecane.
What is the SMILES notation for 11-phenyl-1-oxa-4-azaspiro[5.5]undecane?
The canonical SMILES for 11-phenyl-1-oxa-4-azaspiro[5.5]undecane is c1ccc(C2CCCCC23CNCCO3)cc1.
What is the InChIKey of 11-phenyl-1-oxa-4-azaspiro[5.5]undecane?
The InChIKey is SSSRUVUQHSPIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-6-13(7-3-1)14-8-4-5-9-15(14)12-16-10-11-17-15/h1-3,6-7,14,16H,4-5,8-12H2.
What are the key properties of 11-phenyl-1-oxa-4-azaspiro[5.5]undecane?
11-phenyl-1-oxa-4-azaspiro[5.5]undecane has a molecular weight of 231.34 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-1-oxa-4-azaspiro[5.5]undecane is sourced from PubChem (CID 105403743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).