(3R)-4-methyl-1-azaspiro[2.6]nonane

C9H17N — CID 121388588

IUPAC(3R)-4-methyl-1-azaspiro[2.6]nonane
SMILESCC1CCCCC[C@]12CN2
InChIInChI=1S/C9H17N/c1-8-5-3-2-4-6-9(8)7-10-9/h8,10H,2-7H2,1H3/t8?,9-/m0/s1
InChIKeyBMVCXXUDGWXSOA-GKAPJAKFSA-N
MW139.24 g/mol
LogP1.93
Rot. Bonds

About (3R)-4-methyl-1-azaspiro[2.6]nonane

(3R)-4-methyl-1-azaspiro[2.6]nonane (PubChem CID 121388588) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is (3R)-4-methyl-1-azaspiro[2.6]nonane.

Molecular Properties

Compound Name(3R)-4-methyl-1-azaspiro[2.6]nonane
PubChem CID121388588
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name(3R)-4-methyl-1-azaspiro[2.6]nonane
SMILESCC1CCCCC[C@]12CN2
InChIInChI=1S/C9H17N/c1-8-5-3-2-4-6-9(8)7-10-9/h8,10H,2-7H2,1H3/t8?,9-/m0/s1
InChIKeyBMVCXXUDGWXSOA-GKAPJAKFSA-N
XLogP1.93
TPSA21.94 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3R)-4-methyl-1-azaspiro[2.6]nonane?
The IUPAC name of (3R)-4-methyl-1-azaspiro[2.6]nonane (CID 121388588) is (3R)-4-methyl-1-azaspiro[2.6]nonane.
What is the SMILES notation for (3R)-4-methyl-1-azaspiro[2.6]nonane?
The canonical SMILES for (3R)-4-methyl-1-azaspiro[2.6]nonane is CC1CCCCC[C@]12CN2.
What is the InChIKey of (3R)-4-methyl-1-azaspiro[2.6]nonane?
The InChIKey is BMVCXXUDGWXSOA-GKAPJAKFSA-N. The full InChI is InChI=1S/C9H17N/c1-8-5-3-2-4-6-9(8)7-10-9/h8,10H,2-7H2,1H3/t8?,9-/m0/s1.
What are the key properties of (3R)-4-methyl-1-azaspiro[2.6]nonane?
(3R)-4-methyl-1-azaspiro[2.6]nonane has a molecular weight of 139.24 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-methyl-1-azaspiro[2.6]nonane is sourced from PubChem (CID 121388588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).