(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane

C17H34 — CID 123775313

IUPAC(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane
SMILESCCC(C)(CC1CC1)CC(C)(C)CCC(C)C
InChIInChI=1S/C17H34/c1-7-17(6,12-15-8-9-15)13-16(4,5)11-10-14(2)3/h14-15H,7-13H2,1-6H3
InChIKeyCJRYCCASZCYVQP-UHFFFAOYSA-N
MW238.46 g/mol
LogP6.06
Rot. Bonds8

About (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane

(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane (PubChem CID 123775313) has the molecular formula C17H34 and a molecular weight of 238.46 g/mol. Its IUPAC name is (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane.

Molecular Properties

Compound Name(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane
PubChem CID123775313
Molecular FormulaC17H34
Molecular Weight238.46 g/mol
Exact Mass238.27
IUPAC Name(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane
SMILESCCC(C)(CC1CC1)CC(C)(C)CCC(C)C
InChIInChI=1S/C17H34/c1-7-17(6,12-15-8-9-15)13-16(4,5)11-10-14(2)3/h14-15H,7-13H2,1-6H3
InChIKeyCJRYCCASZCYVQP-UHFFFAOYSA-N
XLogP6.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.46
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane 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

N-(2,2,5-trimethylhexyl)cyclopropanamine
CID 62724341
2-methyl-N-(2-methylpropyl)-2-(oxan-4-ylmethyl)butan-1-amine
CID 55107237
N,3,3,5,5,8-hexamethylnonan-1-amine
CID 146573575
(5-ethyl-5-methylheptyl)cyclopropane
CID 123293142
2-N-(cyclopropylmethyl)-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 63956765
2,2-dimethylpropylcyclobutane;ethane;bis(2-methylbutane)
CID 144526650
3-ethyl-2,3,6-trimethylheptane
CID 53428909
2-methyl-2-(oxan-4-ylmethyl)butan-1-ol
CID 66058541
4-[2-(bromomethyl)-2-methylbutyl]oxane
CID 66050045
3-[3-(2-methoxy-2-methylbutyl)-3,5,5-trimethyloctyl]-7-oxabicyclo[4.1.0]heptane
CID 59944626
(2-ethyl-2,3-dimethylbutyl)cyclobutane
CID 123708911
1-ethyl-4-(3-methylbutyl)cycloheptane
CID 123171853

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane?
The IUPAC name of (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane (CID 123775313) is (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane.
What is the SMILES notation for (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane?
The canonical SMILES for (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane is CCC(C)(CC1CC1)CC(C)(C)CCC(C)C.
What is the InChIKey of (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane?
The InChIKey is CJRYCCASZCYVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34/c1-7-17(6,12-15-8-9-15)13-16(4,5)11-10-14(2)3/h14-15H,7-13H2,1-6H3.
What are the key properties of (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane?
(2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane has a molecular weight of 238.46 g/mol, XLogP of 6.06, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-2,4,4,7-tetramethyloctyl)cyclopropane is sourced from PubChem (CID 123775313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).