4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane

C13H25N — CID 134605127

IUPAC4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane
SMILESCCC1(C(C)C)CNCC12CCCC2
InChIInChI=1S/C13H25N/c1-4-13(11(2)3)10-14-9-12(13)7-5-6-8-12/h11,14H,4-10H2,1-3H3
InChIKeyBXJVLFODXRQRTQ-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds2

About 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane

4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane (PubChem CID 134605127) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane.

Molecular Properties

Compound Name4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane
PubChem CID134605127
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane
SMILESCCC1(C(C)C)CNCC12CCCC2
InChIInChI=1S/C13H25N/c1-4-13(11(2)3)10-14-9-12(13)7-5-6-8-12/h11,14H,4-10H2,1-3H3
InChIKeyBXJVLFODXRQRTQ-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 130592861
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1,2-dioxa-10-azadispiro[2.0.44.33]undecane
CID 141187509
N-[(3-ethylpyrrolidin-3-yl)methyl]propan-2-amine
CID 63143226
3,3-di(propan-2-yl)azepane
CID 58609824
3-propan-2-yl-3-propylazetidine
CID 79452048
7-azadispiro[3.0.45.34]dodecane
CID 83905512
6-azadispiro[2.0.44.43]dodecane
CID 83905513
2-ethyl-2-propan-2-ylazepane
CID 79117006
3-tert-butyl-3-ethylpiperidine
CID 89426414
[1-(1-ethylcyclopentyl)-2-methylpropyl]hydrazine
CID 105281723
N-[(3-ethylpiperidin-3-yl)methyl]propan-2-amine
CID 63133337

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane?
The IUPAC name of 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane (CID 134605127) is 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane.
What is the SMILES notation for 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane?
The canonical SMILES for 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane is CCC1(C(C)C)CNCC12CCCC2.
What is the InChIKey of 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane?
The InChIKey is BXJVLFODXRQRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-13(11(2)3)10-14-9-12(13)7-5-6-8-12/h11,14H,4-10H2,1-3H3.
What are the key properties of 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane?
4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane has a molecular weight of 195.35 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-propan-2-yl-2-azaspiro[4.4]nonane is sourced from PubChem (CID 134605127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).