6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine

C14H21N3O — CID 79914615

IUPAC6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine
SMILESNC(c1cnccn1)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H21N3O/c15-13(12-10-16-6-7-17-12)11-3-8-18-14(9-11)4-1-2-5-14/h6-7,10-11,13H,1-5,8-9,15H2
InChIKeyHTQWRPFGKFUUFX-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.22
Rot. Bonds2

About 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine

6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine (PubChem CID 79914615) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine.

Molecular Properties

Compound Name6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine
PubChem CID79914615
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine
SMILESNC(c1cnccn1)C1CCOC2(CCCC2)C1
InChIInChI=1S/C14H21N3O/c15-13(12-10-16-6-7-17-12)11-3-8-18-14(9-11)4-1-2-5-14/h6-7,10-11,13H,1-5,8-9,15H2
InChIKeyHTQWRPFGKFUUFX-UHFFFAOYSA-N
XLogP2.22
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine with MolForge

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Related Compounds

(4-methyl-2-pyridinyl)-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79914757
5-oxaspiro[3.5]nonan-8-yl(pyridin-4-yl)methanamine
CID 79914138
(3-chloro-4-pyridinyl)-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 105166254
(6-methyl-2-pyridinyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79915425
(4-methylcyclohexyl)-pyrazin-2-ylmethanamine
CID 63967981
(1-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79911247
(2-methyl-1,3-thiazol-5-yl)-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 114031677
(1-methylpyrazol-4-yl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79911940
(4-bromophenyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79922225
N-[1-oxa-9-thiaspiro[5.5]undecan-4-yl(pyrazin-2-yl)methyl]ethanamine
CID 79908127
(1,5-dimethylpyrazol-4-yl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 105170198
[6-oxaspiro[4.5]decan-9-yl(pyridin-3-yl)methyl]hydrazine
CID 105196290

Frequently Asked Questions

What is the IUPAC name of 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine?
The IUPAC name of 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine (CID 79914615) is 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine.
What is the SMILES notation for 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine?
The canonical SMILES for 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine is NC(c1cnccn1)C1CCOC2(CCCC2)C1.
What is the InChIKey of 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine?
The InChIKey is HTQWRPFGKFUUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c15-13(12-10-16-6-7-17-12)11-3-8-18-14(9-11)4-1-2-5-14/h6-7,10-11,13H,1-5,8-9,15H2.
What are the key properties of 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine?
6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine has a molecular weight of 247.34 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxaspiro[4.5]decan-9-yl(pyrazin-2-yl)methanamine is sourced from PubChem (CID 79914615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).