3-ethyl-2-azaspiro[4.5]decane

C11H21N — CID 24822884

IUPAC3-ethyl-2-azaspiro[4.5]decane
SMILESCCC1CC2(CCCCC2)CN1
InChIInChI=1S/C11H21N/c1-2-10-8-11(9-12-10)6-4-3-5-7-11/h10,12H,2-9H2,1H3
InChIKeyBMUGXZKTFKMJHI-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.71
Rot. Bonds1

About 3-ethyl-2-azaspiro[4.5]decane

3-ethyl-2-azaspiro[4.5]decane (PubChem CID 24822884) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 3-ethyl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-ethyl-2-azaspiro[4.5]decane
PubChem CID24822884
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name3-ethyl-2-azaspiro[4.5]decane
SMILESCCC1CC2(CCCCC2)CN1
InChIInChI=1S/C11H21N/c1-2-10-8-11(9-12-10)6-4-3-5-7-11/h10,12H,2-9H2,1H3
InChIKeyBMUGXZKTFKMJHI-UHFFFAOYSA-N
XLogP2.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Azaspiro[4.5]decane
CID 9092
2-Azaspiro(4.5)decane
CID 418822
1,3,3-Trimethyl-6-azabicyclo(3.2.1)octane
CID 103787
2-Cyclohexylpyrrolidine
CID 4637746
4-tert-butyl-N-methylcyclohexan-1-amine
CID 15921596
4-tert-butyl-N-propan-2-ylcyclohexan-1-amine
CID 9120262
3-Cyclohexylpyrrolidine
CID 3159730
3-Methyl-2-azaspiro(4.4)nonane
CID 11564485
1-Azaspiro[4.5]decane hydrochloride
CID 18780563
2-(Cyclohexylmethyl)pyrrolidine
CID 4442674
N,4,4-trimethylcyclohexan-1-amine
CID 550846
2-Azaspiro(4.5)decane, 2-dodecyl-, hydrochloride
CID 13103

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-azaspiro[4.5]decane?
The IUPAC name of 3-ethyl-2-azaspiro[4.5]decane (CID 24822884) is 3-ethyl-2-azaspiro[4.5]decane.
What is the SMILES notation for 3-ethyl-2-azaspiro[4.5]decane?
The canonical SMILES for 3-ethyl-2-azaspiro[4.5]decane is CCC1CC2(CCCCC2)CN1.
What is the InChIKey of 3-ethyl-2-azaspiro[4.5]decane?
The InChIKey is BMUGXZKTFKMJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-2-10-8-11(9-12-10)6-4-3-5-7-11/h10,12H,2-9H2,1H3.
What are the key properties of 3-ethyl-2-azaspiro[4.5]decane?
3-ethyl-2-azaspiro[4.5]decane has a molecular weight of 167.30 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-azaspiro[4.5]decane is sourced from PubChem (CID 24822884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).