1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane

C24H48 — CID 123219017

IUPAC1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane
SMILESCCC(CCCC(C)C(C)C(C)(C)C)CCC1CC1(CC)C(C)C
InChIInChI=1S/C24H48/c1-10-21(14-12-13-19(5)20(6)23(7,8)9)15-16-22-17-24(22,11-2)18(3)4/h18-22H,10-17H2,1-9H3
InChIKeyOWYPDNMILPHRBD-UHFFFAOYSA-N
MW336.65 g/mol
LogP8.35
Rot. Bonds11

About 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane

1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane (PubChem CID 123219017) has the molecular formula C24H48 and a molecular weight of 336.65 g/mol. Its IUPAC name is 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane.

Molecular Properties

Compound Name1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane
PubChem CID123219017
Molecular FormulaC24H48
Molecular Weight336.65 g/mol
Exact Mass336.38
IUPAC Name1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane
SMILESCCC(CCCC(C)C(C)C(C)(C)C)CCC1CC1(CC)C(C)C
InChIInChI=1S/C24H48/c1-10-21(14-12-13-19(5)20(6)23(7,8)9)15-16-22-17-24(22,11-2)18(3)4/h18-22H,10-17H2,1-9H3
InChIKeyOWYPDNMILPHRBD-UHFFFAOYSA-N
XLogP8.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.65
LogP ≤ 58.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,5,5-trimethyl-4-(3,4,5,5-tetramethylhexyl)cyclopentene
CID 140825138
1-ethyl-1,2-di(propan-2-yl)cyclopropane
CID 140630902
(3-ethyl-14-methyl-11-pentan-2-ylhexadecyl)cyclopropane
CID 123672585
3,7-diethylnonane
CID 22089120
1-ethyl-1-heptan-3-yl-2-(3,3,4-trimethylpentan-2-yl)cyclopropane
CID 123906040
1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane
CID 123810045
3-ethylpentylcyclopropane
CID 91030831
6-ethyl-2,3-dimethyldecane
CID 57491764
3-ethyl-2,2,4-trimethylheptane
CID 22354769
2,2,3,4,6-pentamethyloctane
CID 57491075
3,8-diethyl-2,4,12-trimethyl-4-propan-2-yltridecane
CID 123773378
1-(12-ethyl-6,7-dimethyl-4-propylhexadecyl)-1,2-dimethylcyclopropane
CID 123839197

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane?
The IUPAC name of 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane (CID 123219017) is 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane.
What is the SMILES notation for 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane?
The canonical SMILES for 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane is CCC(CCCC(C)C(C)C(C)(C)C)CCC1CC1(CC)C(C)C.
What is the InChIKey of 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane?
The InChIKey is OWYPDNMILPHRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48/c1-10-21(14-12-13-19(5)20(6)23(7,8)9)15-16-22-17-24(22,11-2)18(3)4/h18-22H,10-17H2,1-9H3.
What are the key properties of 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane?
1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane has a molecular weight of 336.65 g/mol, XLogP of 8.35, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane is sourced from PubChem (CID 123219017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).