1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine

C11H22N2O — CID 83959945

IUPAC1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine
SMILESCC(N)CN1CCC2(COC2)C(C)C1
InChIInChI=1S/C11H22N2O/c1-9-5-13(6-10(2)12)4-3-11(9)7-14-8-11/h9-10H,3-8,12H2,1-2H3
InChIKeyGAPLRDRLVLLAGB-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.69
Rot. Bonds2

About 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine

1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine (PubChem CID 83959945) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine.

Molecular Properties

Compound Name1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine
PubChem CID83959945
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine
SMILESCC(N)CN1CCC2(COC2)C(C)C1
InChIInChI=1S/C11H22N2O/c1-9-5-13(6-10(2)12)4-3-11(9)7-14-8-11/h9-10H,3-8,12H2,1-2H3
InChIKeyGAPLRDRLVLLAGB-UHFFFAOYSA-N
XLogP0.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[9-(aminomethyl)-5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl]propan-2-amine
CID 83959948
(2R)-1-(6-azaspiro[2.5]octan-6-yl)propan-2-amine
CID 122669555
(2S)-1-(3,4-dimethylpiperazin-1-yl)propan-2-amine
CID 103934656
(2R)-1-(5-azaspiro[2.4]heptan-5-yl)propan-2-amine
CID 122669538
1-(5-azaspiro[2.4]heptan-5-yl)propan-2-amine
CID 122669550
(2S)-1-(3,3-difluoropyrrolidin-1-yl)propan-2-amine
CID 131212587
(2S)-1-(3-methoxy-4-methylpiperidin-1-yl)propan-2-amine
CID 102965393
(2S)-1-(2-ethylmorpholin-4-yl)propan-2-amine
CID 103934483
1-(3,5-dimethylpiperazin-1-yl)propan-2-amine
CID 67575948
2-(8-methyl-6-azaspiro[2.5]octan-6-yl)ethanol
CID 83959936
(2S)-1-(2-azaspiro[4.5]decan-2-yl)propan-2-amine
CID 130516410
(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol
CID 124547059

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine?
The IUPAC name of 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine (CID 83959945) is 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine.
What is the SMILES notation for 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine?
The canonical SMILES for 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine is CC(N)CN1CCC2(COC2)C(C)C1.
What is the InChIKey of 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine?
The InChIKey is GAPLRDRLVLLAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-5-13(6-10(2)12)4-3-11(9)7-14-8-11/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine?
1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine has a molecular weight of 198.31 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-2-amine is sourced from PubChem (CID 83959945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).