(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane

C9H17NO — CID 98042391

IUPAC(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane
SMILESCC1(C)C[C@@]2(CCNC2)CO1
InChIInChI=1S/C9H17NO/c1-8(2)5-9(7-11-8)3-4-10-6-9/h10H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyVLVLCKNPSNJGDP-SECBINFHSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds

About (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane

(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane (PubChem CID 98042391) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane
PubChem CID98042391
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane
SMILESCC1(C)C[C@@]2(CCNC2)CO1
InChIInChI=1S/C9H17NO/c1-8(2)5-9(7-11-8)3-4-10-6-9/h10H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyVLVLCKNPSNJGDP-SECBINFHSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7,7-dimethyl-6-oxa-2-azaspiro[3.4]octane;hydrochloride
CID 165475352
3,3-dimethyl-2,4-dioxa-9-azaspiro[5.5]undecane
CID 82655471
2,8-diazaspiro[4.5]decane;ethane
CID 143048064
2,7-diazaspiro[3.4]octane;ethane
CID 143687523
2,7-diazaspiro[3.4]octane;ethane
CID 171068778
2,7-diazaspiro[3.4]octane;propane
CID 177136819
3,3-dimethyl-1,2,5-trioxa-9-azaspiro[5.5]undecane
CID 86050095
2-methyl-7-aza-2-azoniaspiro[4.4]nonane
CID 173145851
(5R)-2,9-diazaspiro[4.5]decane
CID 86326439
6,6-dimethyl-1,4-diazocane
CID 139442519
3,3,8-trimethyl-2,7-dioxaspiro[4.4]nonane
CID 24971562
11-azadispiro[4.2.58.25]pentadecane
CID 114820262

Frequently Asked Questions

What is the IUPAC name of (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane?
The IUPAC name of (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane (CID 98042391) is (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane?
The canonical SMILES for (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane is CC1(C)C[C@@]2(CCNC2)CO1.
What is the InChIKey of (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane?
The InChIKey is VLVLCKNPSNJGDP-SECBINFHSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)5-9(7-11-8)3-4-10-6-9/h10H,3-7H2,1-2H3/t9-/m1/s1.
What are the key properties of (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane?
(5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane has a molecular weight of 155.24 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3,3-dimethyl-2-oxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 98042391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).