8-ethyl-1-methyl-2-propylspiro[2.7]decane

C16H30 — CID 123742873

IUPAC8-ethyl-1-methyl-2-propylspiro[2.7]decane
SMILESCCCC1C(C)C12CCCCC(CC)CC2
InChIInChI=1S/C16H30/c1-4-8-15-13(3)16(15)11-7-6-9-14(5-2)10-12-16/h13-15H,4-12H2,1-3H3
InChIKeyFUXIDNFZGQJVPP-UHFFFAOYSA-N
MW222.42 g/mol
LogP5.42
Rot. Bonds3

About 8-ethyl-1-methyl-2-propylspiro[2.7]decane

8-ethyl-1-methyl-2-propylspiro[2.7]decane (PubChem CID 123742873) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is 8-ethyl-1-methyl-2-propylspiro[2.7]decane.

Molecular Properties

Compound Name8-ethyl-1-methyl-2-propylspiro[2.7]decane
PubChem CID123742873
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Name8-ethyl-1-methyl-2-propylspiro[2.7]decane
SMILESCCCC1C(C)C12CCCCC(CC)CC2
InChIInChI=1S/C16H30/c1-4-8-15-13(3)16(15)11-7-6-9-14(5-2)10-12-16/h13-15H,4-12H2,1-3H3
InChIKeyFUXIDNFZGQJVPP-UHFFFAOYSA-N
XLogP5.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
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cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
ethane;bis(ethylcyclopentane)
CID 158911237
chromium;bis(ethylcyclopentane)
CID 91996240
1,1-dimethyl-4-propylcyclotridecane
CID 123608299
ethylcyclopentane;methanamine
CID 142068671
magnesium;carbanide;bis(ethylcyclopentane)
CID 121233150
carbanide;bis(ethylcyclopentane);tungsten dihydride
CID 164887185
1-ethyl-4-methylcyclooctane;methane
CID 159989571
ethane;ethylcyclopentane;1-methyl-1-propylcyclohexane
CID 153335761
1,1-bis(4-propylcyclohexyl)cyclohexane
CID 54232179

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-1-methyl-2-propylspiro[2.7]decane?
The IUPAC name of 8-ethyl-1-methyl-2-propylspiro[2.7]decane (CID 123742873) is 8-ethyl-1-methyl-2-propylspiro[2.7]decane.
What is the SMILES notation for 8-ethyl-1-methyl-2-propylspiro[2.7]decane?
The canonical SMILES for 8-ethyl-1-methyl-2-propylspiro[2.7]decane is CCCC1C(C)C12CCCCC(CC)CC2.
What is the InChIKey of 8-ethyl-1-methyl-2-propylspiro[2.7]decane?
The InChIKey is FUXIDNFZGQJVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30/c1-4-8-15-13(3)16(15)11-7-6-9-14(5-2)10-12-16/h13-15H,4-12H2,1-3H3.
What are the key properties of 8-ethyl-1-methyl-2-propylspiro[2.7]decane?
8-ethyl-1-methyl-2-propylspiro[2.7]decane has a molecular weight of 222.42 g/mol, XLogP of 5.42, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-1-methyl-2-propylspiro[2.7]decane is sourced from PubChem (CID 123742873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).