1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane

C180H368F2 — CID 158339052

IUPAC1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane
SMILESCC(C)C1CC(C(C)C)C1.CC(C)CC(C)CC(C)C.CC(C)CC1CC(C(C)C)C1.CC(C)CC1CC1C(C)C.CC(C)CC1CC1CC(C)C.CC(C)CC1CCC1(C)C.CC(C)CCC(C)C(C)C.CC(C)CCC1(C(C)C)CC1.CC(C)CCC1CC1(C)C.CC(C)CCC1CCC1(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)F.CC(C)CCCC(C)C.CC(C)CCCC1CC1(C)C.CC(C)CCCCC(C)C.CC(C)c1ccc(C(C)C)cc1.CCC(F)CC
InChIInChI=1S/C12H18.5C11H22.4C10H20.5C10H22.C9H19F.C9H20.C5H11F/c1-9(2)11-5-7-12(8-6-11)10(3)4;1-8(2)5-10-6-11(7-10)9(3)4;1-8(2)5-10-7-11(10)6-9(3)4;1-9(2)5-6-10-7-8-11(10,3)4;1-9(2)5-6-11(7-8-11)10(3)4;1-9(2)6-5-7-10-8-11(10,3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)5-9-6-10(9)8(3)4;1-8(2)7-9-5-6-10(9,3)4;1-8(2)5-6-9-7-10(9,3)4;1-8(2)6-10(5)7-9(3)4;2*1-9(2)7-6-8-10(3,4)5;1-8(2)6-7-10(5)9(3)4;1-9(2)7-5-6-8-10(3)4;1-8(2)6-5-7-9(3,4)10;1-8(2)6-5-7-9(3)4;1-3-5(6)4-2/h5-10H,1-4H3;2*8-11H,5-7H2,1-4H3;3*9-10H,5-8H2,1-4H3;2*7-10H,5-6H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-10H,6-7H2,1-5H3;2*9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;8H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;5H,3-4H2,1-2H3
InChIKeyGQYAATPIMIWAMD-UHFFFAOYSA-N
MW2570.92 g/mol
LogP64.71
Rot. Bonds59

About 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane

1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane (PubChem CID 158339052) has the molecular formula C180H368F2 and a molecular weight of 2570.92 g/mol. Its IUPAC name is 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane.

Molecular Properties

Compound Name1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane
PubChem CID158339052
Molecular FormulaC180H368F2
Molecular Weight2570.92 g/mol
Exact Mass2568.88
IUPAC Name1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane
SMILESCC(C)C1CC(C(C)C)C1.CC(C)CC(C)CC(C)C.CC(C)CC1CC(C(C)C)C1.CC(C)CC1CC1C(C)C.CC(C)CC1CC1CC(C)C.CC(C)CC1CCC1(C)C.CC(C)CCC(C)C(C)C.CC(C)CCC1(C(C)C)CC1.CC(C)CCC1CC1(C)C.CC(C)CCC1CCC1(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)F.CC(C)CCCC(C)C.CC(C)CCCC1CC1(C)C.CC(C)CCCCC(C)C.CC(C)c1ccc(C(C)C)cc1.CCC(F)CC
InChIInChI=1S/C12H18.5C11H22.4C10H20.5C10H22.C9H19F.C9H20.C5H11F/c1-9(2)11-5-7-12(8-6-11)10(3)4;1-8(2)5-10-6-11(7-10)9(3)4;1-8(2)5-10-7-11(10)6-9(3)4;1-9(2)5-6-10-7-8-11(10,3)4;1-9(2)5-6-11(7-8-11)10(3)4;1-9(2)6-5-7-10-8-11(10,3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)5-9-6-10(9)8(3)4;1-8(2)7-9-5-6-10(9,3)4;1-8(2)5-6-9-7-10(9,3)4;1-8(2)6-10(5)7-9(3)4;2*1-9(2)7-6-8-10(3,4)5;1-8(2)6-7-10(5)9(3)4;1-9(2)7-5-6-8-10(3)4;1-8(2)6-5-7-9(3,4)10;1-8(2)6-5-7-9(3)4;1-3-5(6)4-2/h5-10H,1-4H3;2*8-11H,5-7H2,1-4H3;3*9-10H,5-8H2,1-4H3;2*7-10H,5-6H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-10H,6-7H2,1-5H3;2*9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;8H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;5H,3-4H2,1-2H3
InChIKeyGQYAATPIMIWAMD-UHFFFAOYSA-N
XLogP64.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds59
Heavy Atoms182
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002570.92
LogP ≤ 564.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane?
The IUPAC name of 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane (CID 158339052) is 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane.
What is the SMILES notation for 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane?
The canonical SMILES for 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane is CC(C)C1CC(C(C)C)C1.CC(C)CC(C)CC(C)C.CC(C)CC1CC(C(C)C)C1.CC(C)CC1CC1C(C)C.CC(C)CC1CC1CC(C)C.CC(C)CC1CCC1(C)C.CC(C)CCC(C)C(C)C.CC(C)CCC1(C(C)C)CC1.CC(C)CCC1CC1(C)C.CC(C)CCC1CCC1(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)C.CC(C)CCCC(C)(C)F.CC(C)CCCC(C)C.CC(C)CCCC1CC1(C)C.CC(C)CCCCC(C)C.CC(C)c1ccc(C(C)C)cc1.CCC(F)CC.
What is the InChIKey of 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane?
The InChIKey is GQYAATPIMIWAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18.5C11H22.4C10H20.5C10H22.C9H19F.C9H20.C5H11F/c1-9(2)11-5-7-12(8-6-11)10(3)4;1-8(2)5-10-6-11(7-10)9(3)4;1-8(2)5-10-7-11(10)6-9(3)4;1-9(2)5-6-10-7-8-11(10,3)4;1-9(2)5-6-11(7-8-11)10(3)4;1-9(2)6-5-7-10-8-11(10,3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)5-9-6-10(9)8(3)4;1-8(2)7-9-5-6-10(9,3)4;1-8(2)5-6-9-7-10(9,3)4;1-8(2)6-10(5)7-9(3)4;2*1-9(2)7-6-8-10(3,4)5;1-8(2)6-7-10(5)9(3)4;1-9(2)7-5-6-8-10(3)4;1-8(2)6-5-7-9(3,4)10;1-8(2)6-5-7-9(3)4;1-3-5(6)4-2/h5-10H,1-4H3;2*8-11H,5-7H2,1-4H3;3*9-10H,5-8H2,1-4H3;2*7-10H,5-6H2,1-4H3;2*8-9H,5-7H2,1-4H3;8-10H,6-7H2,1-5H3;2*9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;8H,5-7H2,1-4H3;8-9H,5-7H2,1-4H3;5H,3-4H2,1-2H3.
What are the key properties of 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane?
1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane has a molecular weight of 2570.92 g/mol, XLogP of 64.71, 59 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-methylpropyl)cyclopropane;2,6-dimethylheptane;1,1-dimethyl-2-(3-methylbutyl)cyclobutane;1,1-dimethyl-2-(3-methylbutyl)cyclopropane;1,1-dimethyl-2-(4-methylpentyl)cyclopropane;1,1-dimethyl-2-(2-methylpropyl)cyclobutane;2,7-dimethyloctane;1,4-di(propan-2-yl)benzene;1,3-di(propan-2-yl)cyclobutane;2-fluoro-2,6-dimethylheptane;3-fluoropentane;1-(3-methylbutyl)-1-propan-2-ylcyclopropane;1-(2-methylpropyl)-3-propan-2-ylcyclobutane;1-(2-methylpropyl)-2-propan-2-ylcyclopropane;bis(2,2,6-trimethylheptane);2,3,6-trimethylheptane;2,4,6-trimethylheptane is sourced from PubChem (CID 158339052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).