1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane

C19H38 — CID 123235703

IUPAC1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane
SMILESCCCC(C)C(CC)C(C)CCC(C)CC1CC1C
InChIInChI=1S/C19H38/c1-7-9-15(4)19(8-2)16(5)11-10-14(3)12-18-13-17(18)6/h14-19H,7-13H2,1-6H3
InChIKeyCUKVGXCHAFEZJS-UHFFFAOYSA-N
MW266.51 g/mol
LogP6.55
Rot. Bonds10

About 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane

1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane (PubChem CID 123235703) has the molecular formula C19H38 and a molecular weight of 266.51 g/mol. Its IUPAC name is 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane
PubChem CID123235703
Molecular FormulaC19H38
Molecular Weight266.51 g/mol
Exact Mass266.30
IUPAC Name1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane
SMILESCCCC(C)C(CC)C(C)CCC(C)CC1CC1C
InChIInChI=1S/C19H38/c1-7-9-15(4)19(8-2)16(5)11-10-14(3)12-18-13-17(18)6/h14-19H,7-13H2,1-6H3
InChIKeyCUKVGXCHAFEZJS-UHFFFAOYSA-N
XLogP6.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.51
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane?
The IUPAC name of 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane (CID 123235703) is 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane.
What is the SMILES notation for 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane?
The canonical SMILES for 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane is CCCC(C)C(CC)C(C)CCC(C)CC1CC1C.
What is the InChIKey of 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane?
The InChIKey is CUKVGXCHAFEZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38/c1-7-9-15(4)19(8-2)16(5)11-10-14(3)12-18-13-17(18)6/h14-19H,7-13H2,1-6H3.
What are the key properties of 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane?
1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane has a molecular weight of 266.51 g/mol, XLogP of 6.55, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethyl-2,5,7-trimethyldecyl)-2-methylcyclopropane is sourced from PubChem (CID 123235703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).