furan;1-methyl-3-propylbenzene

C14H18O — CID 90871497

IUPACfuran;1-methyl-3-propylbenzene
SMILESCCCc1cccc(C)c1.c1ccoc1
InChIInChI=1S/C10H14.C4H4O/c1-3-5-10-7-4-6-9(2)8-10;1-2-4-5-3-1/h4,6-8H,3,5H2,1-2H3;1-4H
InChIKeyWCQDRJFGFVFLGZ-UHFFFAOYSA-N
MW202.30 g/mol
LogP4.23
Rot. Bonds2

About furan;1-methyl-3-propylbenzene

furan;1-methyl-3-propylbenzene (PubChem CID 90871497) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is furan;1-methyl-3-propylbenzene.

Molecular Properties

Compound Namefuran;1-methyl-3-propylbenzene
PubChem CID90871497
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Namefuran;1-methyl-3-propylbenzene
SMILESCCCc1cccc(C)c1.c1ccoc1
InChIInChI=1S/C10H14.C4H4O/c1-3-5-10-7-4-6-9(2)8-10;1-2-4-5-3-1/h4,6-8H,3,5H2,1-2H3;1-4H
InChIKeyWCQDRJFGFVFLGZ-UHFFFAOYSA-N
XLogP4.23
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-3-propylbenzene;prop-2-enenitrile
CID 144542987
ethane;1-methyl-3-pentylbenzene
CID 143267779
1-butyl-3-methylbenzene;ethane;propane
CID 142068173
1-methyl-3-[8-(3-methylphenyl)octyl]benzene
CID 22920080
2-(3-methylphenyl)ethanolate
CID 142208639
ethane;bis(1-ethyl-3-methylbenzene)
CID 142878274
benzene;propylbenzene;toluene
CID 142060228
2-(3-methylphenyl)ethanamine;hydrochloride
CID 47003273
1-(3,3-difluorobutyl)-3-methylbenzene
CID 169204430
1-methyl-3-[4-(4-propylphenyl)phenyl]benzene
CID 123480159
2-[2-(3-methylphenyl)ethyl]-4-propylbenzoic acid
CID 70281448
1-ethyl-3-methylbenzene;methanamine
CID 167447790

Frequently Asked Questions

What is the IUPAC name of furan;1-methyl-3-propylbenzene?
The IUPAC name of furan;1-methyl-3-propylbenzene (CID 90871497) is furan;1-methyl-3-propylbenzene.
What is the SMILES notation for furan;1-methyl-3-propylbenzene?
The canonical SMILES for furan;1-methyl-3-propylbenzene is CCCc1cccc(C)c1.c1ccoc1.
What is the InChIKey of furan;1-methyl-3-propylbenzene?
The InChIKey is WCQDRJFGFVFLGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14.C4H4O/c1-3-5-10-7-4-6-9(2)8-10;1-2-4-5-3-1/h4,6-8H,3,5H2,1-2H3;1-4H.
What are the key properties of furan;1-methyl-3-propylbenzene?
furan;1-methyl-3-propylbenzene has a molecular weight of 202.30 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1-methyl-3-propylbenzene is sourced from PubChem (CID 90871497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).