2-butan-2-yl-1,3-dimethylcyclopentane

C11H22 — CID 90760041

IUPAC2-butan-2-yl-1,3-dimethylcyclopentane
SMILESCCC(C)C1C(C)CCC1C
InChIInChI=1S/C11H22/c1-5-8(2)11-9(3)6-7-10(11)4/h8-11H,5-7H2,1-4H3
InChIKeyMSKQYTRKVNUDPQ-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.71
Rot. Bonds2

About 2-butan-2-yl-1,3-dimethylcyclopentane

2-butan-2-yl-1,3-dimethylcyclopentane (PubChem CID 90760041) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 2-butan-2-yl-1,3-dimethylcyclopentane.

Molecular Properties

Compound Name2-butan-2-yl-1,3-dimethylcyclopentane
PubChem CID90760041
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name2-butan-2-yl-1,3-dimethylcyclopentane
SMILESCCC(C)C1C(C)CCC1C
InChIInChI=1S/C11H22/c1-5-8(2)11-9(3)6-7-10(11)4/h8-11H,5-7H2,1-4H3
InChIKeyMSKQYTRKVNUDPQ-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-butan-2-yl-1,3-dimethylcyclohexane
CID 123219049
2-butan-2-yl-1,3,5-trimethylcyclohexane
CID 90972647
1,3-dimethyl-2-pentan-3-ylcyclopentane
CID 123708942
1-butan-2-yl-2,3-dimethylcyclopentane;ethane;ethene
CID 144517503
3-butan-2-yl-2,6-dimethylcyclohexan-1-ol
CID 58534554
2-butan-2-yl-1-methyl-3-(3-methylpentan-2-yl)cyclobutane
CID 90870897
2-butan-2-yl-3-ethyl-5-methylcyclopentan-1-amine
CID 155282268
1-butan-2-yl-4-methylcyclohexane
CID 20676481
2,3-di(butan-2-yl)cyclopropan-1-amine
CID 123532822
2-[(2S)-butan-2-yl]-1,1,3-trimethylcyclohexane
CID 163963914
4-butan-2-yl-1,1,3-trimethylcyclohexane
CID 142412996
1-butan-2-yl-3,4-dimethyl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 123302694

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-1,3-dimethylcyclopentane?
The IUPAC name of 2-butan-2-yl-1,3-dimethylcyclopentane (CID 90760041) is 2-butan-2-yl-1,3-dimethylcyclopentane.
What is the SMILES notation for 2-butan-2-yl-1,3-dimethylcyclopentane?
The canonical SMILES for 2-butan-2-yl-1,3-dimethylcyclopentane is CCC(C)C1C(C)CCC1C.
What is the InChIKey of 2-butan-2-yl-1,3-dimethylcyclopentane?
The InChIKey is MSKQYTRKVNUDPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-8(2)11-9(3)6-7-10(11)4/h8-11H,5-7H2,1-4H3.
What are the key properties of 2-butan-2-yl-1,3-dimethylcyclopentane?
2-butan-2-yl-1,3-dimethylcyclopentane has a molecular weight of 154.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-1,3-dimethylcyclopentane is sourced from PubChem (CID 90760041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).