1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene

C19H24 — CID 123328001

IUPAC1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene
SMILESCCCc1cccc(C(C)(C)c2ccc(C)cc2)c1
InChIInChI=1S/C19H24/c1-5-7-16-8-6-9-18(14-16)19(3,4)17-12-10-15(2)11-13-17/h6,8-14H,5,7H2,1-4H3
InChIKeyMDWMXSDINWWLPR-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.27
Rot. Bonds4

About 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene

1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene (PubChem CID 123328001) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene.

Molecular Properties

Compound Name1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene
PubChem CID123328001
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Name1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene
SMILESCCCc1cccc(C(C)(C)c2ccc(C)cc2)c1
InChIInChI=1S/C19H24/c1-5-7-16-8-6-9-18(14-16)19(3,4)17-12-10-15(2)11-13-17/h6,8-14H,5,7H2,1-4H3
InChIKeyMDWMXSDINWWLPR-UHFFFAOYSA-N
XLogP5.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.40
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-4-[2-[3-[2-methyl-2-(4-methylphenyl)propyl]phenyl]propan-2-yl]benzene
CID 143650354
1-methyl-4-(2-phenylpropan-2-yl)benzene;1-methyl-4-[2-[3-(2-phenylpropan-2-yl)phenyl]propan-2-yl]benzene;1-methyl-4-[2-[4-(2-phenylpropan-2-yl)phenyl]propan-2-yl]benzene
CID 159818582
1-(2-methylsulfanylpropan-2-yl)-3-propylbenzene
CID 91471137
1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol
CID 116542790
1-tert-butyl-3-(2,2-dimethylpropyl)benzene;1-(2,2-dimethylpropyl)-3-propylbenzene
CID 145400173
butane;methane;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;propane
CID 159232750
3-(3-propylphenyl)pentan-3-ol
CID 116542305
1-(4-fluorophenyl)-1-(3-propylphenyl)ethanol
CID 116542276
1-methyl-4-[2-[4-[2-(4-nonylphenyl)propan-2-yl]phenyl]propan-2-yl]benzene
CID 159793185
1,4-diethylbenzene;methane;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene
CID 159662015
1-(4-methylphenoxy)-4-[4-[4-[2-[3-[2-(4-methylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]phenoxy]benzene
CID 159990763
1,1,1,3,3,3-hexafluoro-2-(3-propylphenyl)propan-2-ol
CID 20728974

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene?
The IUPAC name of 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene (CID 123328001) is 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene.
What is the SMILES notation for 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene?
The canonical SMILES for 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene is CCCc1cccc(C(C)(C)c2ccc(C)cc2)c1.
What is the InChIKey of 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene?
The InChIKey is MDWMXSDINWWLPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-5-7-16-8-6-9-18(14-16)19(3,4)17-12-10-15(2)11-13-17/h6,8-14H,5,7H2,1-4H3.
What are the key properties of 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene?
1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene has a molecular weight of 252.40 g/mol, XLogP of 5.27, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene is sourced from PubChem (CID 123328001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).