[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine

C15H15F2NO — CID 115790299

IUPAC[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine
SMILESCc1cccc(C(N)c2ccccc2OC(F)F)c1
InChIInChI=1S/C15H15F2NO/c1-10-5-4-6-11(9-10)14(18)12-7-2-3-8-13(12)19-15(16)17/h2-9,14-15H,18H2,1H3
InChIKeyNFVLPDOQFSWSNF-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.64
Rot. Bonds4

About [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine

[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine (PubChem CID 115790299) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine.

Molecular Properties

Compound Name[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine
PubChem CID115790299
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine
SMILESCc1cccc(C(N)c2ccccc2OC(F)F)c1
InChIInChI=1S/C15H15F2NO/c1-10-5-4-6-11(9-10)14(18)12-7-2-3-8-13(12)19-15(16)17/h2-9,14-15H,18H2,1H3
InChIKeyNFVLPDOQFSWSNF-UHFFFAOYSA-N
XLogP3.64
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanol
CID 63895753
(2-methylphenyl)-(3-methylphenyl)methanamine
CID 43828955
2-[amino-(3-methylphenyl)methyl]aniline
CID 118675282
[2-(difluoromethoxy)phenyl]-pyrimidin-5-ylmethanamine
CID 115827479
[2-(difluoromethoxy)phenyl]-(2,5-dimethylthiophen-3-yl)methanamine
CID 43322455
1-[2-(difluoromethoxy)phenyl]-2-(3-methylphenyl)ethanol
CID 63017552
[2-(difluoromethoxy)phenyl]-(5-fluoro-3-pyridinyl)methanamine
CID 115805107
[3-(difluoromethoxy)phenyl]-(2-fluoro-3-methoxyphenyl)methanamine
CID 105025170
[3-(difluoromethoxy)phenyl]-(5-fluoro-2-methylphenyl)methanamine
CID 115852067
(2,5-dibromothiophen-3-yl)-[2-(difluoromethoxy)phenyl]methanamine
CID 43345041
(2,5-dichlorophenyl)-[2-(difluoromethoxy)phenyl]methanamine
CID 43344658
(2-chlorophenyl)-[3-(difluoromethoxy)phenyl]methanamine
CID 115801705

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine?
The IUPAC name of [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine (CID 115790299) is [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine.
What is the SMILES notation for [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine?
The canonical SMILES for [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine is Cc1cccc(C(N)c2ccccc2OC(F)F)c1.
What is the InChIKey of [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine?
The InChIKey is NFVLPDOQFSWSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-10-5-4-6-11(9-10)14(18)12-7-2-3-8-13(12)19-15(16)17/h2-9,14-15H,18H2,1H3.
What are the key properties of [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine?
[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine has a molecular weight of 263.29 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanamine is sourced from PubChem (CID 115790299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).