1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane

C19H32 — CID 123299083

IUPAC1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane
SMILESC=C(C)C(=C1CC(C)(CC)C1C)C1(C)CCC1CC
InChIInChI=1S/C19H32/c1-8-15-10-11-19(15,7)17(13(3)4)16-12-18(6,9-2)14(16)5/h14-15H,3,8-12H2,1-2,4-7H3
InChIKeyKFBSPWBBGKWANR-UHFFFAOYSA-N
MW260.46 g/mol
LogP6.14
Rot. Bonds4

About 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane

1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane (PubChem CID 123299083) has the molecular formula C19H32 and a molecular weight of 260.46 g/mol. Its IUPAC name is 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane.

Molecular Properties

Compound Name1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane
PubChem CID123299083
Molecular FormulaC19H32
Molecular Weight260.46 g/mol
Exact Mass260.25
IUPAC Name1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane
SMILESC=C(C)C(=C1CC(C)(CC)C1C)C1(C)CCC1CC
InChIInChI=1S/C19H32/c1-8-15-10-11-19(15,7)17(13(3)4)16-12-18(6,9-2)14(16)5/h14-15H,3,8-12H2,1-2,4-7H3
InChIKeyKFBSPWBBGKWANR-UHFFFAOYSA-N
XLogP6.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.46
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane with MolForge

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Related Compounds

azane;2-ethyl-1,1-dimethylcyclobutane
CID 174315226
1,3-diethyl-1,2,2-trimethylcyclopentane
CID 123762745
CID 173483395
CID 173483395
1-ethyl-1,2-dimethyl-4-propan-2-ylidenecyclobutane
CID 91173457
1,2-dimethyl-4-methylidene-1-prop-1-en-2-ylcyclopentane
CID 20644989
3,4-diethyl-3-methylcyclohexene-1,2-dicarboxylic acid
CID 175560562
(1,2-diethylcyclooctyl) 2-methylprop-2-enoate
CID 175495311
[3-ethyl-3a-methyl-6-(3-methylbut-3-enyl)-7-methylidene-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-6-yl]phosphane
CID 144867285
4-ethyl-2,2,3,4-tetramethylcyclohexan-1-ol
CID 123306354
1,1-dimethyl-2-(2-methylprop-2-enyl)cyclopentane
CID 123815942
1,3-diethyl-1,2-dimethylcyclohexane
CID 123496519
1,2,3-trimethyl-1-prop-1-en-2-ylcyclohexane
CID 91136006

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane?
The IUPAC name of 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane (CID 123299083) is 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane.
What is the SMILES notation for 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane?
The canonical SMILES for 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane is C=C(C)C(=C1CC(C)(CC)C1C)C1(C)CCC1CC.
What is the InChIKey of 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane?
The InChIKey is KFBSPWBBGKWANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32/c1-8-15-10-11-19(15,7)17(13(3)4)16-12-18(6,9-2)14(16)5/h14-15H,3,8-12H2,1-2,4-7H3.
What are the key properties of 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane?
1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane has a molecular weight of 260.46 g/mol, XLogP of 6.14, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[1-(2-ethyl-1-methylcyclobutyl)-2-methylprop-2-enylidene]-1,2-dimethylcyclobutane is sourced from PubChem (CID 123299083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).