1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane

C15H30 — CID 123810045

IUPAC1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane
SMILESCCC(C)(C)C1CC(CC)(C(C)C)C1C
InChIInChI=1S/C15H30/c1-8-14(6,7)13-10-15(9-2,11(3)4)12(13)5/h11-13H,8-10H2,1-7H3
InChIKeyNIQQRZJAPOKCAC-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.13
Rot. Bonds4

About 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane

1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane (PubChem CID 123810045) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane.

Molecular Properties

Compound Name1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane
PubChem CID123810045
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane
SMILESCCC(C)(C)C1CC(CC)(C(C)C)C1C
InChIInChI=1S/C15H30/c1-8-14(6,7)13-10-15(9-2,11(3)4)12(13)5/h11-13H,8-10H2,1-7H3
InChIKeyNIQQRZJAPOKCAC-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-1,2-di(propan-2-yl)cyclopropane
CID 140630902
2,3-dimethyl-1-propan-2-yl-1-propylcyclobutane
CID 123295211
2-(2-ethyl-2-propan-2-ylcyclopropyl)-1-propan-2-ylguanidine
CID 122098461
1-ethyl-2-fluoro-1-(1,1,1-trifluoropropan-2-yl)cyclopropane
CID 121274151
1-(2,3-dimethylpentan-3-yl)-1,2-dimethylcyclopropane
CID 123741342
2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane
CID 123981733
8-tert-butyl-7-ethyl-7-propan-2-yl-1,4-dioxaspiro[4.5]decane
CID 137483062
3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane
CID 123889417
2,3-diethyl-3-propan-2-ylpyrrolidine
CID 62354581
1-ethyl-2-(3-ethyl-7,8,9,9-tetramethyldecyl)-1-propan-2-ylcyclopropane
CID 123219017
1,1-diethyl-3-propan-2-ylcyclobutane
CID 162172993
2-(2-methylbutan-2-yl)bicyclo[3.1.1]heptane
CID 123158926

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane?
The IUPAC name of 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane (CID 123810045) is 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane.
What is the SMILES notation for 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane?
The canonical SMILES for 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane is CCC(C)(C)C1CC(CC)(C(C)C)C1C.
What is the InChIKey of 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane?
The InChIKey is NIQQRZJAPOKCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-8-14(6,7)13-10-15(9-2,11(3)4)12(13)5/h11-13H,8-10H2,1-7H3.
What are the key properties of 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane?
1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane has a molecular weight of 210.40 g/mol, XLogP of 5.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-3-(2-methylbutan-2-yl)-1-propan-2-ylcyclobutane is sourced from PubChem (CID 123810045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).