1-(1-phenylpropan-2-yl)-2-propylbenzene

C18H22 — CID 18968363

IUPAC1-(1-phenylpropan-2-yl)-2-propylbenzene
SMILESCCCc1ccccc1C(C)Cc1ccccc1
InChIInChI=1S/C18H22/c1-3-9-17-12-7-8-13-18(17)15(2)14-16-10-5-4-6-11-16/h4-8,10-13,15H,3,9,14H2,1-2H3
InChIKeyWRCVPPBVQMVCMI-UHFFFAOYSA-N
MW238.37 g/mol
LogP4.99
Rot. Bonds5

About 1-(1-phenylpropan-2-yl)-2-propylbenzene

1-(1-phenylpropan-2-yl)-2-propylbenzene (PubChem CID 18968363) has the molecular formula C18H22 and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(1-phenylpropan-2-yl)-2-propylbenzene.

Molecular Properties

Compound Name1-(1-phenylpropan-2-yl)-2-propylbenzene
PubChem CID18968363
Molecular FormulaC18H22
Molecular Weight238.37 g/mol
Exact Mass238.17
IUPAC Name1-(1-phenylpropan-2-yl)-2-propylbenzene
SMILESCCCc1ccccc1C(C)Cc1ccccc1
InChIInChI=1S/C18H22/c1-3-9-17-12-7-8-13-18(17)15(2)14-16-10-5-4-6-11-16/h4-8,10-13,15H,3,9,14H2,1-2H3
InChIKeyWRCVPPBVQMVCMI-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-butan-2-yl-2-(2-phenylethyl)benzene
CID 22235126
N-methyl-2-(2-propylphenyl)propan-1-amine
CID 105425339
1-methyl-2-(1-phenylpropan-2-yl)benzene
CID 22356709
1-(1-phenylpropan-2-yl)-4-propylbenzene
CID 57021691
1-[(E)-hex-4-en-2-yl]-2-propylbenzene
CID 145391504
2-[1-(2,3-dipropylphenyl)propan-2-yl]phenol
CID 67252187
1-benzyl-2,3-dipropylbenzene
CID 22920914
1-butan-2-yl-2-butylbenzene;ethane;propane
CID 144927563
[(2R)-1-phenylpropan-2-yl]benzene
CID 11138041
1-(4-cyclohexylbutan-2-yl)-2-propylbenzene
CID 142148571
1,2-di(propan-2-yl)-3-propylbenzene;hydrogen peroxide
CID 172751409
ethane;1-phenylpropan-2-ylbenzene
CID 142097323

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylpropan-2-yl)-2-propylbenzene?
The IUPAC name of 1-(1-phenylpropan-2-yl)-2-propylbenzene (CID 18968363) is 1-(1-phenylpropan-2-yl)-2-propylbenzene.
What is the SMILES notation for 1-(1-phenylpropan-2-yl)-2-propylbenzene?
The canonical SMILES for 1-(1-phenylpropan-2-yl)-2-propylbenzene is CCCc1ccccc1C(C)Cc1ccccc1.
What is the InChIKey of 1-(1-phenylpropan-2-yl)-2-propylbenzene?
The InChIKey is WRCVPPBVQMVCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22/c1-3-9-17-12-7-8-13-18(17)15(2)14-16-10-5-4-6-11-16/h4-8,10-13,15H,3,9,14H2,1-2H3.
What are the key properties of 1-(1-phenylpropan-2-yl)-2-propylbenzene?
1-(1-phenylpropan-2-yl)-2-propylbenzene has a molecular weight of 238.37 g/mol, XLogP of 4.99, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylpropan-2-yl)-2-propylbenzene is sourced from PubChem (CID 18968363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).