1-methyl-2-(3-propylphenyl)benzene

C16H18 — CID 143365994

IUPAC1-methyl-2-(3-propylphenyl)benzene
SMILESCCCc1cccc(-c2ccccc2C)c1
InChIInChI=1S/C16H18/c1-3-7-14-9-6-10-15(12-14)16-11-5-4-8-13(16)2/h4-6,8-12H,3,7H2,1-2H3
InChIKeyANWFFPVLQSZOIL-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.61
Rot. Bonds3

About 1-methyl-2-(3-propylphenyl)benzene

1-methyl-2-(3-propylphenyl)benzene (PubChem CID 143365994) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-methyl-2-(3-propylphenyl)benzene.

Molecular Properties

Compound Name1-methyl-2-(3-propylphenyl)benzene
PubChem CID143365994
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Name1-methyl-2-(3-propylphenyl)benzene
SMILESCCCc1cccc(-c2ccccc2C)c1
InChIInChI=1S/C16H18/c1-3-7-14-9-6-10-15(12-14)16-11-5-4-8-13(16)2/h4-6,8-12H,3,7H2,1-2H3
InChIKeyANWFFPVLQSZOIL-UHFFFAOYSA-N
XLogP4.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-dimethyl-2-(3-propylphenyl)benzene
CID 173395390
N,N-dimethyl-3-[3-(2-methylphenyl)phenyl]propan-1-amine
CID 170865946
1-phenyl-3-propylbenzene
CID 4110465
N-methyl-1-[4-methyl-3-(3-propylphenyl)phenyl]methanamine
CID 105409508
1-butyl-2-(3-butylphenyl)benzene
CID 142022154
5-[3-(2-methylphenyl)phenyl]pentanoyl chloride
CID 57305905
N-[[3-methyl-4-(3-propylphenyl)phenyl]methyl]propan-2-amine
CID 116545316
4-methyl-2-(3-propylphenyl)phenol
CID 116546527
2-ethyl-4-methylazulene
CID 154376639
[3-(3-propylphenyl)phenyl]methanamine
CID 1392934
N-[1-[2-(3-propylphenyl)phenyl]ethyl]propan-1-amine
CID 116545311
2-(2-methylphenyl)-1,3,5-tripropylbenzene
CID 90909135

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(3-propylphenyl)benzene?
The IUPAC name of 1-methyl-2-(3-propylphenyl)benzene (CID 143365994) is 1-methyl-2-(3-propylphenyl)benzene.
What is the SMILES notation for 1-methyl-2-(3-propylphenyl)benzene?
The canonical SMILES for 1-methyl-2-(3-propylphenyl)benzene is CCCc1cccc(-c2ccccc2C)c1.
What is the InChIKey of 1-methyl-2-(3-propylphenyl)benzene?
The InChIKey is ANWFFPVLQSZOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18/c1-3-7-14-9-6-10-15(12-14)16-11-5-4-8-13(16)2/h4-6,8-12H,3,7H2,1-2H3.
What are the key properties of 1-methyl-2-(3-propylphenyl)benzene?
1-methyl-2-(3-propylphenyl)benzene has a molecular weight of 210.32 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(3-propylphenyl)benzene is sourced from PubChem (CID 143365994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).