1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane

C14H24 — CID 134975780

IUPAC1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane
SMILESCCCCC1(C)C(=C=C(C)C)C1(C)C
InChIInChI=1S/C14H24/c1-7-8-9-14(6)12(10-11(2)3)13(14,4)5/h7-9H2,1-6H3
InChIKeyDETULAMHJCWSNA-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.71
Rot. Bonds3

About 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane

1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane (PubChem CID 134975780) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane.

Molecular Properties

Compound Name1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane
PubChem CID134975780
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane
SMILESCCCCC1(C)C(=C=C(C)C)C1(C)C
InChIInChI=1S/C14H24/c1-7-8-9-14(6)12(10-11(2)3)13(14,4)5/h7-9H2,1-6H3
InChIKeyDETULAMHJCWSNA-UHFFFAOYSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane?
The IUPAC name of 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane (CID 134975780) is 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane.
What is the SMILES notation for 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane?
The canonical SMILES for 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane is CCCCC1(C)C(=C=C(C)C)C1(C)C.
What is the InChIKey of 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane?
The InChIKey is DETULAMHJCWSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-7-8-9-14(6)12(10-11(2)3)13(14,4)5/h7-9H2,1-6H3.
What are the key properties of 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane?
1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane has a molecular weight of 192.35 g/mol, XLogP of 4.71, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-1,2,2-trimethyl-3-(2-methylprop-1-enylidene)cyclopropane is sourced from PubChem (CID 134975780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).