1-methyl-2-[(3-methylphenoxy)methyl]benzene

C15H16O — CID 60627935

IUPAC1-methyl-2-[(3-methylphenoxy)methyl]benzene
SMILESCc1cccc(OCc2ccccc2C)c1
InChIInChI=1S/C15H16O/c1-12-6-5-9-15(10-12)16-11-14-8-4-3-7-13(14)2/h3-10H,11H2,1-2H3
InChIKeyIDRVHGKFVAOVEW-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.88
Rot. Bonds3

About 1-methyl-2-[(3-methylphenoxy)methyl]benzene

1-methyl-2-[(3-methylphenoxy)methyl]benzene (PubChem CID 60627935) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-methyl-2-[(3-methylphenoxy)methyl]benzene.

Molecular Properties

Compound Name1-methyl-2-[(3-methylphenoxy)methyl]benzene
PubChem CID60627935
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name1-methyl-2-[(3-methylphenoxy)methyl]benzene
SMILESCc1cccc(OCc2ccccc2C)c1
InChIInChI=1S/C15H16O/c1-12-6-5-9-15(10-12)16-11-14-8-4-3-7-13(14)2/h3-10H,11H2,1-2H3
InChIKeyIDRVHGKFVAOVEW-UHFFFAOYSA-N
XLogP3.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-2-[(3-methylphenoxy)methyl]benzene
CID 70995774
1,2-dichloro-3-[(3-methylphenoxy)methyl]benzene
CID 107310396
N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
CID 19744687
1-[3-[(2-methylphenyl)methoxy]phenyl]ethanone
CID 765227
5-methyl-2-[(3-methylphenoxy)methyl]phenol
CID 117221129
3-[(3-methylphenoxy)methyl]pyridin-2-amine
CID 62465645
N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]propan-2-amine
CID 39368949
1-[(2S)-1-methoxypropan-2-yl]oxy-3-[(2-methylphenyl)methoxy]benzene
CID 141165604
1,3-dimethyl-5-[(3-methylphenoxy)methyl]benzene
CID 60644540
N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]propan-1-amine
CID 39368953
3-[2-[(3-methylphenoxy)methyl]phenyl]prop-2-enoic acid
CID 76908529
7-methyl-2-[(3-methylphenoxy)methyl]-1-benzofuran
CID 117186365

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(3-methylphenoxy)methyl]benzene?
The IUPAC name of 1-methyl-2-[(3-methylphenoxy)methyl]benzene (CID 60627935) is 1-methyl-2-[(3-methylphenoxy)methyl]benzene.
What is the SMILES notation for 1-methyl-2-[(3-methylphenoxy)methyl]benzene?
The canonical SMILES for 1-methyl-2-[(3-methylphenoxy)methyl]benzene is Cc1cccc(OCc2ccccc2C)c1.
What is the InChIKey of 1-methyl-2-[(3-methylphenoxy)methyl]benzene?
The InChIKey is IDRVHGKFVAOVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-12-6-5-9-15(10-12)16-11-14-8-4-3-7-13(14)2/h3-10H,11H2,1-2H3.
What are the key properties of 1-methyl-2-[(3-methylphenoxy)methyl]benzene?
1-methyl-2-[(3-methylphenoxy)methyl]benzene has a molecular weight of 212.29 g/mol, XLogP of 3.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(3-methylphenoxy)methyl]benzene is sourced from PubChem (CID 60627935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).