5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine

C14H13F3N2O — CID 133424088

IUPAC5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccccc1F)c1ccc(OC(F)F)cn1
InChIInChI=1S/C14H13F3N2O/c1-19(9-10-4-2-3-5-12(10)15)13-7-6-11(8-18-13)20-14(16)17/h2-8,14H,9H2,1H3
InChIKeyZFKSMTYSDKJFTM-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.46
Rot. Bonds5

About 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine

5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine (PubChem CID 133424088) has the molecular formula C14H13F3N2O and a molecular weight of 282.27 g/mol. Its IUPAC name is 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
PubChem CID133424088
Molecular FormulaC14H13F3N2O
Molecular Weight282.27 g/mol
Exact Mass282.10
IUPAC Name5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccccc1F)c1ccc(OC(F)F)cn1
InChIInChI=1S/C14H13F3N2O/c1-19(9-10-4-2-3-5-12(10)15)13-7-6-11(8-18-13)20-14(16)17/h2-8,14H,9H2,1H3
InChIKeyZFKSMTYSDKJFTM-UHFFFAOYSA-N
XLogP3.46
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(difluoromethoxy)-N-[(4-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 133424069
N-[(2-fluorophenyl)methyl]-N,5-dimethylpyrimidin-2-amine
CID 171701097
N-[4-(difluoromethoxy)phenyl]-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 9035433
6-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylpyrazin-2-amine
CID 66456456
2-[(2-fluorophenyl)methyl-methylamino]pyrimidine-5-carbaldehyde
CID 113387633
5-(bromomethyl)-N-[(2-fluorophenyl)methyl]-N-methylpyrimidin-2-amine
CID 107080917
N-[(2-fluorophenyl)methyl]-N-methyl-6-[(propan-2-ylamino)methyl]pyridazin-3-amine
CID 62294083
6-[(2-fluorophenyl)methyl-methylamino]pyrimidine-4-carbonitrile
CID 115143016
5-(chloromethyl)-N-[(2-fluorophenyl)methyl]-N,4-dimethylpyrimidin-2-amine
CID 83184048
N-[(2-fluorophenyl)methyl]-6-hydrazinyl-N-methylpyrazin-2-amine
CID 80899484
1-(2-fluorophenyl)-N-(methoxymethyl)-N-methylmethanamine
CID 115258763
4-N-[(2-fluorophenyl)methyl]-2-N,4-N,5-trimethylpyrimidine-2,4-diamine
CID 80794967

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine (CID 133424088) is 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine is CN(Cc1ccccc1F)c1ccc(OC(F)F)cn1.
What is the InChIKey of 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The InChIKey is ZFKSMTYSDKJFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c1-19(9-10-4-2-3-5-12(10)15)13-7-6-11(8-18-13)20-14(16)17/h2-8,14H,9H2,1H3.
What are the key properties of 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine?
5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine has a molecular weight of 282.27 g/mol, XLogP of 3.46, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 133424088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).