7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane

C12H23N — CID 89399793

IUPAC7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane
SMILESCC(C)C1CC2(CCN(C)CC2)C1
InChIInChI=1S/C12H23N/c1-10(2)11-8-12(9-11)4-6-13(3)7-5-12/h10-11H,4-9H2,1-3H3
InChIKeyYFKIIQZZFNMWLN-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.76
Rot. Bonds1

About 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane

7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane (PubChem CID 89399793) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane
PubChem CID89399793
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane
SMILESCC(C)C1CC2(CCN(C)CC2)C1
InChIInChI=1S/C12H23N/c1-10(2)11-8-12(9-11)4-6-13(3)7-5-12/h10-11H,4-9H2,1-3H3
InChIKeyYFKIIQZZFNMWLN-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane?
The IUPAC name of 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane (CID 89399793) is 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane.
What is the SMILES notation for 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane?
The canonical SMILES for 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane is CC(C)C1CC2(CCN(C)CC2)C1.
What is the InChIKey of 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane?
The InChIKey is YFKIIQZZFNMWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10(2)11-8-12(9-11)4-6-13(3)7-5-12/h10-11H,4-9H2,1-3H3.
What are the key properties of 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane?
7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane has a molecular weight of 181.32 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-propan-2-yl-7-azaspiro[3.5]nonane is sourced from PubChem (CID 89399793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).