3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane

C15H30 — CID 123889417

IUPAC3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane
SMILESCCCC1(C)CC(C(C)(C)C(C)C)C1C
InChIInChI=1S/C15H30/c1-8-9-15(7)10-13(12(15)4)14(5,6)11(2)3/h11-13H,8-10H2,1-7H3
InChIKeyCVAQMIRCKVDRFR-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.13
Rot. Bonds4

About 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane

3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane (PubChem CID 123889417) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane.

Molecular Properties

Compound Name3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane
PubChem CID123889417
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane
SMILESCCCC1(C)CC(C(C)(C)C(C)C)C1C
InChIInChI=1S/C15H30/c1-8-9-15(7)10-13(12(15)4)14(5,6)11(2)3/h11-13H,8-10H2,1-7H3
InChIKeyCVAQMIRCKVDRFR-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

2-butan-2-yl-1-methyl-1-propylcyclobutane
CID 145223890
1,2,3-trimethyl-1-propylcyclopentane
CID 91062709
2,3-dimethyl-1-propan-2-yl-1-propylcyclobutane
CID 123295211
2-(2,3-dimethylbutan-2-yl)-5-methylcyclohexan-1-ol
CID 64766518
1-methyl-2-propan-2-yl-1-propylcyclobutane
CID 123382647
1-(2,3-dimethylpentan-3-yl)-1,2-dimethylcyclopropane
CID 123741342
3-bromo-2,3-dimethylpentane
CID 54167618
1,2-dimethyl-1-pentan-2-ylcyclopropane
CID 91541433
1,2-dimethyl-3-propan-2-yl-1-propylcyclopropane
CID 90948897
2-methyl-N-[(2-methyl-2-propylcyclopropyl)methyl]propan-1-amine
CID 62714427
1-methyl-2-propyl-2-(2,3,4,4-tetramethylhexyl)bicyclo[1.1.0]butane
CID 91369928
2,3-dimethyl-1,1-dipropylcyclobutane
CID 143150497

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane?
The IUPAC name of 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane (CID 123889417) is 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane.
What is the SMILES notation for 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane?
The canonical SMILES for 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane is CCCC1(C)CC(C(C)(C)C(C)C)C1C.
What is the InChIKey of 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane?
The InChIKey is CVAQMIRCKVDRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-8-9-15(7)10-13(12(15)4)14(5,6)11(2)3/h11-13H,8-10H2,1-7H3.
What are the key properties of 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane?
3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane 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 3-(2,3-dimethylbutan-2-yl)-1,2-dimethyl-1-propylcyclobutane is sourced from PubChem (CID 123889417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).