1,4-dimethyl-2-(3-propylphenyl)benzene

C17H20 — CID 173395390

IUPAC1,4-dimethyl-2-(3-propylphenyl)benzene
SMILESCCCc1cccc(-c2cc(C)ccc2C)c1
InChIInChI=1S/C17H20/c1-4-6-15-7-5-8-16(12-15)17-11-13(2)9-10-14(17)3/h5,7-12H,4,6H2,1-3H3
InChIKeyDHFKRPJIYSIDBI-UHFFFAOYSA-N
MW224.35 g/mol
LogP4.92
Rot. Bonds3

About 1,4-dimethyl-2-(3-propylphenyl)benzene

1,4-dimethyl-2-(3-propylphenyl)benzene (PubChem CID 173395390) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1,4-dimethyl-2-(3-propylphenyl)benzene.

Molecular Properties

Compound Name1,4-dimethyl-2-(3-propylphenyl)benzene
PubChem CID173395390
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name1,4-dimethyl-2-(3-propylphenyl)benzene
SMILESCCCc1cccc(-c2cc(C)ccc2C)c1
InChIInChI=1S/C17H20/c1-4-6-15-7-5-8-16(12-15)17-11-13(2)9-10-14(17)3/h5,7-12H,4,6H2,1-3H3
InChIKeyDHFKRPJIYSIDBI-UHFFFAOYSA-N
XLogP4.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-2-(3-propylphenyl)phenol
CID 116546527
1-methyl-2-(3-propylphenyl)benzene
CID 143365994
3-[3-(2,5-dimethylphenyl)phenyl]propanoic acid
CID 82120152
N-methyl-1-[4-methyl-3-(3-propylphenyl)phenyl]methanamine
CID 105409508
5-methyl-3-(3-propylphenyl)pyridin-2-amine
CID 116545619
4-ethyl-1-methyl-2-(3-methylphenyl)benzene
CID 91311090
1-phenyl-3-propylbenzene
CID 4110465
2-[3-(2,4-dimethylphenyl)phenyl]ethanamine
CID 82115094
1-methyl-4-phenyl-2-(4-propylphenyl)benzene
CID 123627409
[3-(3-propylphenyl)phenyl]methanamine
CID 1392934
2-(3-methoxyphenyl)-1,4-dimethylbenzene
CID 66641424
4-propyl-6-(3-propylphenyl)benzene-1,3-diol
CID 71009376

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2-(3-propylphenyl)benzene?
The IUPAC name of 1,4-dimethyl-2-(3-propylphenyl)benzene (CID 173395390) is 1,4-dimethyl-2-(3-propylphenyl)benzene.
What is the SMILES notation for 1,4-dimethyl-2-(3-propylphenyl)benzene?
The canonical SMILES for 1,4-dimethyl-2-(3-propylphenyl)benzene is CCCc1cccc(-c2cc(C)ccc2C)c1.
What is the InChIKey of 1,4-dimethyl-2-(3-propylphenyl)benzene?
The InChIKey is DHFKRPJIYSIDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20/c1-4-6-15-7-5-8-16(12-15)17-11-13(2)9-10-14(17)3/h5,7-12H,4,6H2,1-3H3.
What are the key properties of 1,4-dimethyl-2-(3-propylphenyl)benzene?
1,4-dimethyl-2-(3-propylphenyl)benzene has a molecular weight of 224.35 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-(3-propylphenyl)benzene is sourced from PubChem (CID 173395390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).