2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane

C15H29NO — CID 20605122

IUPAC2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane
SMILESCN1C(C)(C)CC2(CCC(C)(C)O2)CC1(C)C
InChIInChI=1S/C15H29NO/c1-12(2)10-15(9-8-14(5,6)17-15)11-13(3,4)16(12)7/h8-11H2,1-7H3
InChIKeyDLCCLNWLCKMTEB-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.60
Rot. Bonds

About 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane

2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane (PubChem CID 20605122) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane
PubChem CID20605122
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane
SMILESCN1C(C)(C)CC2(CCC(C)(C)O2)CC1(C)C
InChIInChI=1S/C15H29NO/c1-12(2)10-15(9-8-14(5,6)17-15)11-13(3,4)16(12)7/h8-11H2,1-7H3
InChIKeyDLCCLNWLCKMTEB-UHFFFAOYSA-N
XLogP3.60
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,2,4,6,6-Hexamethyl-4-octadecoxypiperidine
CID 20492335
8-Hydroxy-2,2,7,7,9,9-hexamethyl-1-oxa-8-azaspiro[4.5]decane
CID 20605125
2,2,8-Trimethyl-1-oxa-8-azaspiro[4.5]decane
CID 21050543
7,9-Diethyl-2,2,7,8,9-pentamethyl-1-oxa-8-azaspiro[4.5]decane
CID 23377094
2,2,7,8-Tetramethyl-7,9,9-tritritio-1-oxa-8-azaspiro[4.5]decane
CID 57847780
8-Tert-butyl-3-ethyl-3-methoxy-8-azabicyclo[3.2.1]octane
CID 58584479
2,2,7,7,8,9,9-Heptamethyl-1-oxa-8-azoniaspiro[4.5]decane
CID 58692075
2,2,8-Trimethyl-7,7,9,9-tetratritio-1-oxa-8-azaspiro[4.5]decane
CID 58700166
3-Ethyl-3-methoxy-8-propan-2-yl-8-azabicyclo[3.2.1]octane
CID 59275781
8-Tert-butyl-1-oxa-8-azaspiro[4.5]decane
CID 60090245
8-Methyl-3-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane
CID 66634713
3-Ethyl-3-methoxy-8-methyl-8-azabicyclo[3.2.1]octane
CID 67567487

Frequently Asked Questions

What is the IUPAC name of 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane (CID 20605122) is 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane is CN1C(C)(C)CC2(CCC(C)(C)O2)CC1(C)C.
What is the InChIKey of 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is DLCCLNWLCKMTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(2)10-15(9-8-14(5,6)17-15)11-13(3,4)16(12)7/h8-11H2,1-7H3.
What are the key properties of 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane?
2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 239.40 g/mol, XLogP of 3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,7,7,8,9,9-heptamethyl-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 20605122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).