N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine

C13H12F2N2 — CID 113278289

IUPACN-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine
SMILESCc1cncc(NCc2cccc(F)c2F)c1
InChIInChI=1S/C13H12F2N2/c1-9-5-11(8-16-6-9)17-7-10-3-2-4-12(14)13(10)15/h2-6,8,17H,7H2,1H3
InChIKeyWTVGDLQMXRCHDN-UHFFFAOYSA-N
MW234.25 g/mol
LogP3.28
Rot. Bonds3

About N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine

N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine (PubChem CID 113278289) has the molecular formula C13H12F2N2 and a molecular weight of 234.25 g/mol. Its IUPAC name is N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine
PubChem CID113278289
Molecular FormulaC13H12F2N2
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC NameN-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine
SMILESCc1cncc(NCc2cccc(F)c2F)c1
InChIInChI=1S/C13H12F2N2/c1-9-5-11(8-16-6-9)17-7-10-3-2-4-12(14)13(10)15/h2-6,8,17H,7H2,1H3
InChIKeyWTVGDLQMXRCHDN-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,3-difluorophenyl)methyl]-5-fluoropyridin-3-amine
CID 114217557
N-[(2-fluoro-5-methylphenyl)methyl]-5-methylpyridin-3-amine
CID 103824043
5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine
CID 115748884
5-methyl-N-[(3,4,5-trifluorophenyl)methyl]pyridin-3-amine
CID 103824113
N-[(2,5-dichlorophenyl)methyl]-5-methylpyridin-3-amine
CID 103845205
N-[(2,3-difluorophenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 63668922
N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-methylpyridin-3-amine
CID 103824022
N-(3,5-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233459
N-[(2,3-difluorophenyl)methyl]-4-methylsulfanylaniline
CID 43425578
3-[(2,3-difluorophenyl)methylamino]phenol
CID 63667379
4-[(2,3-difluorophenyl)methylamino]-2-fluorophenol
CID 64795401
N-[3-[(2,3-difluorophenyl)methylamino]phenyl]acetamide
CID 43425139

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine?
The IUPAC name of N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine (CID 113278289) is N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine.
What is the SMILES notation for N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine?
The canonical SMILES for N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine is Cc1cncc(NCc2cccc(F)c2F)c1.
What is the InChIKey of N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine?
The InChIKey is WTVGDLQMXRCHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2/c1-9-5-11(8-16-6-9)17-7-10-3-2-4-12(14)13(10)15/h2-6,8,17H,7H2,1H3.
What are the key properties of N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine?
N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine has a molecular weight of 234.25 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-difluorophenyl)methyl]-5-methylpyridin-3-amine is sourced from PubChem (CID 113278289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).