propan-2-ylcyclobutane;1,4-xylene

C15H24 — CID 161065038

IUPACpropan-2-ylcyclobutane;1,4-xylene
SMILESCC(C)C1CCC1.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C7H14/c1-7-3-5-8(2)6-4-7;1-6(2)7-4-3-5-7/h3-6H,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyUDXIMXVNATXOEI-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.75
Rot. Bonds1

About propan-2-ylcyclobutane;1,4-xylene

propan-2-ylcyclobutane;1,4-xylene (PubChem CID 161065038) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is propan-2-ylcyclobutane;1,4-xylene.

Molecular Properties

Compound Namepropan-2-ylcyclobutane;1,4-xylene
PubChem CID161065038
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Namepropan-2-ylcyclobutane;1,4-xylene
SMILESCC(C)C1CCC1.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C7H14/c1-7-3-5-8(2)6-4-7;1-6(2)7-4-3-5-7/h3-6H,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyUDXIMXVNATXOEI-UHFFFAOYSA-N
XLogP4.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

N-[(1R)-1-(4-methylphenyl)ethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81349637
(4-methylphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 65424560
(1S)-1-cyclobutyl-N-[(4-methylphenyl)methyl]ethanamine
CID 118957385
2-cyclobutyl-2-(4-methylphenyl)ethanamine
CID 55269565
1-(4-methylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63406811
N-[1-(4-methylphenyl)ethyl]-3-propan-2-ylcyclobutan-1-amine
CID 103561638
1-cyclopentyl-N-[1-(4-methylphenyl)ethyl]ethanamine
CID 55097109
2-(4-methylphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423604
2-(1-cyclobutylethyl)-5-methylpyridine
CID 121401029
benzene;propan-2-ylcyclohexane
CID 163364158
1-cyclobutylethylbenzene
CID 22024745
(1R)-1-cyclopentyl-N-[(4-methylphenyl)methyl]ethanamine
CID 81394920

Frequently Asked Questions

What is the IUPAC name of propan-2-ylcyclobutane;1,4-xylene?
The IUPAC name of propan-2-ylcyclobutane;1,4-xylene (CID 161065038) is propan-2-ylcyclobutane;1,4-xylene.
What is the SMILES notation for propan-2-ylcyclobutane;1,4-xylene?
The canonical SMILES for propan-2-ylcyclobutane;1,4-xylene is CC(C)C1CCC1.Cc1ccc(C)cc1.
What is the InChIKey of propan-2-ylcyclobutane;1,4-xylene?
The InChIKey is UDXIMXVNATXOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.C7H14/c1-7-3-5-8(2)6-4-7;1-6(2)7-4-3-5-7/h3-6H,1-2H3;6-7H,3-5H2,1-2H3.
What are the key properties of propan-2-ylcyclobutane;1,4-xylene?
propan-2-ylcyclobutane;1,4-xylene has a molecular weight of 204.36 g/mol, XLogP of 4.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-ylcyclobutane;1,4-xylene is sourced from PubChem (CID 161065038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).