1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane

C17H32 — CID 90753292

IUPAC1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane
SMILESCCC1CC(C)C1CC(C)C1CC(C)C1CC
InChIInChI=1S/C17H32/c1-6-14-8-11(3)16(14)9-13(5)17-10-12(4)15(17)7-2/h11-17H,6-10H2,1-5H3
InChIKeyYIFRCDAJNIHQCY-UHFFFAOYSA-N
MW236.44 g/mol
LogP5.38
Rot. Bonds5

About 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane

1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane (PubChem CID 90753292) has the molecular formula C17H32 and a molecular weight of 236.44 g/mol. Its IUPAC name is 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane.

Molecular Properties

Compound Name1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane
PubChem CID90753292
Molecular FormulaC17H32
Molecular Weight236.44 g/mol
Exact Mass236.25
IUPAC Name1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane
SMILESCCC1CC(C)C1CC(C)C1CC(C)C1CC
InChIInChI=1S/C17H32/c1-6-14-8-11(3)16(14)9-13(5)17-10-12(4)15(17)7-2/h11-17H,6-10H2,1-5H3
InChIKeyYIFRCDAJNIHQCY-UHFFFAOYSA-N
XLogP5.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.44
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6,10,14-Tetramethyl-7-(3-methyl-pentyl)-pentadecane
CID 14275206
Tetradecane, 7,8-dimethyl
CID 530303
2,3-Dimethylheptadecane
CID 537320
2,6,10,14,18-Pentamethyl-7-(3-methyl-pentyl)-nonadecane
CID 14139292
Hydrogenated didecene
CID 530173
Npc293700
CID 518459
2,6,10-Trimethyl-7-(3-methylbutyl)dodecane
CID 6430052
2,3-Dimethyl-pentadecane
CID 22404705
2,3-Dimethyltetradecane
CID 53428962
Cembrane
CID 15702
11-Pentan-3-ylhenicosane
CID 292291
2,3-Dimethylnonadecane
CID 537326

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane?
The IUPAC name of 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane (CID 90753292) is 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane.
What is the SMILES notation for 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane?
The canonical SMILES for 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane is CCC1CC(C)C1CC(C)C1CC(C)C1CC.
What is the InChIKey of 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane?
The InChIKey is YIFRCDAJNIHQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32/c1-6-14-8-11(3)16(14)9-13(5)17-10-12(4)15(17)7-2/h11-17H,6-10H2,1-5H3.
What are the key properties of 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane?
1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane has a molecular weight of 236.44 g/mol, XLogP of 5.38, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane is sourced from PubChem (CID 90753292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).