1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine

C11H22N2O — CID 165444888

IUPAC1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine
SMILESCCCN1CCC(N)C12CCOCC2
InChIInChI=1S/C11H22N2O/c1-2-6-13-7-3-10(12)11(13)4-8-14-9-5-11/h10H,2-9,12H2,1H3
InChIKeyGFPRBHHJWMNRPM-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.98
Rot. Bonds2

About 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine

1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine (PubChem CID 165444888) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine
PubChem CID165444888
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine
SMILESCCCN1CCC(N)C12CCOCC2
InChIInChI=1S/C11H22N2O/c1-2-6-13-7-3-10(12)11(13)4-8-14-9-5-11/h10H,2-9,12H2,1H3
InChIKeyGFPRBHHJWMNRPM-UHFFFAOYSA-N
XLogP0.98
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 ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-4-tert-butyl-1-ethyl-8-oxa-1-azaspiro[4.5]decane
CID 154953071
(4R)-1-ethyl-4-methyl-7-oxa-1-azaspiro[4.4]nonane
CID 152875103
4-methyl-4-azaspiro[2.4]heptan-7-amine;dihydrochloride
CID 105451908
1-propyl-7-oxa-1-azaspiro[4.4]nonan-4-one
CID 165461992
1-ethyl-2-methylpyrrolidine-2,3-diamine
CID 68953775
4-[[1-(1-propylpiperidin-4-yl)ethylamino]methyl]oxan-4-ol
CID 81131022
1,8-dimethyl-1-azaspiro[4.5]decan-4-amine
CID 83828566
N-[4-(aminomethyl)oxan-4-yl]-N,1-dimethylpiperidin-4-amine
CID 54942199
4-[[(1-propylpiperidin-4-yl)amino]methyl]oxan-4-ol
CID 81130595
1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine
CID 117017786
1-(4-ethoxyoxan-4-yl)pyrrolidin-3-amine
CID 69399739
ethane;4-propylmorpholine
CID 143004992

Frequently Asked Questions

What is the IUPAC name of 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine?
The IUPAC name of 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine (CID 165444888) is 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine?
The canonical SMILES for 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine is CCCN1CCC(N)C12CCOCC2.
What is the InChIKey of 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine?
The InChIKey is GFPRBHHJWMNRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-6-13-7-3-10(12)11(13)4-8-14-9-5-11/h10H,2-9,12H2,1H3.
What are the key properties of 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine?
1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine has a molecular weight of 198.31 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-8-oxa-1-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 165444888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).