2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane

C9H17NO2 — CID 21054008

IUPAC2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane
SMILESCC1CC2(CN1C)OCCCO2
InChIInChI=1S/C9H17NO2/c1-8-6-9(7-10(8)2)11-4-3-5-12-9/h8H,3-7H2,1-2H3
InChIKeyMEZZEDYELFVFCE-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.84
Rot. Bonds

About 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane

2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane (PubChem CID 21054008) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane
PubChem CID21054008
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane
SMILESCC1CC2(CN1C)OCCCO2
InChIInChI=1S/C9H17NO2/c1-8-6-9(7-10(8)2)11-4-3-5-12-9/h8H,3-7H2,1-2H3
InChIKeyMEZZEDYELFVFCE-UHFFFAOYSA-N
XLogP0.84
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 58699792
CID 58699792
(8R)-7,8-dimethyl-1,4-dioxa-7-azaspiro[4.4]nonane
CID 67522507
7,8-Dimethyl-1,4-dioxa-7-azaspiro[4.4]nonane
CID 77306362
9-Propan-2-yl-1,4-dioxa-9-azaspiro[4.5]decane
CID 81723005
9-Butan-2-yl-1,4-dioxa-9-azaspiro[4.5]decane
CID 81723538
7-Ethyl-8-methyl-1,4-dioxa-7-azaspiro[4.4]nonane
CID 90054026
3-(Oxan-2-yloxy)-1-propan-2-ylpyrrolidine
CID 91262290
2,3-Di(propan-2-yl)-6,10-dioxa-2-azaspiro[4.5]decane
CID 117709935
1-Ethyl-4,4-dimethoxy-2-methylpyrrolidine
CID 124134572
1-Methyl-6,10-dioxa-2-azaspiro[4.5]decane
CID 129125871
4,4-Dimethoxy-1,2-dimethylpyrrolidine
CID 130193925
(3R)-2-tert-butyl-3,8,8-trimethyl-6,10-dioxa-2-azaspiro[4.5]decane
CID 130396673

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane?
The IUPAC name of 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane (CID 21054008) is 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane.
What is the SMILES notation for 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane?
The canonical SMILES for 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane is CC1CC2(CN1C)OCCCO2.
What is the InChIKey of 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane?
The InChIKey is MEZZEDYELFVFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-8-6-9(7-10(8)2)11-4-3-5-12-9/h8H,3-7H2,1-2H3.
What are the key properties of 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane?
2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane has a molecular weight of 171.24 g/mol, XLogP of 0.84, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6,10-dioxa-2-azaspiro[4.5]decane is sourced from PubChem (CID 21054008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).