1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine

C14H15FN2 — CID 113469674

IUPAC1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cncc(-c2ccc(F)cc2C)c1
InChIInChI=1S/C14H15FN2/c1-10-5-13(15)3-4-14(10)12-6-11(7-16-2)8-17-9-12/h3-6,8-9,16H,7H2,1-2H3
InChIKeyISJAFSLRBDKOQD-UHFFFAOYSA-N
MW230.29 g/mol
LogP2.92
Rot. Bonds3

About 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine

1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine (PubChem CID 113469674) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine
PubChem CID113469674
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC Name1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cncc(-c2ccc(F)cc2C)c1
InChIInChI=1S/C14H15FN2/c1-10-5-13(15)3-4-14(10)12-6-11(7-16-2)8-17-9-12/h3-6,8-9,16H,7H2,1-2H3
InChIKeyISJAFSLRBDKOQD-UHFFFAOYSA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2,3-difluoro-4-methylphenyl)-3-pyridinyl]-N-methylmethanamine
CID 107514107
1-[4-(4-fluoro-2-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66481802
5-(4-fluoro-2-methylphenyl)pyridine-3-carbaldehyde
CID 112694203
5-(4-fluoro-2-methylphenyl)-N,3-dimethylpyridin-2-amine
CID 134417245
1-[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 79690685
N-[[5-(2,3-difluoro-4-methylphenyl)-3-pyridinyl]methyl]cyclopropanamine
CID 107514144
1-cyclopropyl-N-[[5-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]methyl]methanamine
CID 72943649
3-(chloromethyl)-5-(2,4-difluorophenyl)pyridine
CID 165454838
1-[5-(2-methoxy-3-pyridinyl)-3-pyridinyl]-N-methylmethanamine
CID 167816225
1-[5-(3-ethylphenyl)-3-pyridinyl]-N-methylmethanamine
CID 113469756
[5-[2-methyl-4-(trifluoromethyl)phenyl]-3-pyridinyl]methanamine
CID 102755639
4-(4-fluoro-2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]aniline
CID 166351963

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine (CID 113469674) is 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine is CNCc1cncc(-c2ccc(F)cc2C)c1.
What is the InChIKey of 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is ISJAFSLRBDKOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c1-10-5-13(15)3-4-14(10)12-6-11(7-16-2)8-17-9-12/h3-6,8-9,16H,7H2,1-2H3.
What are the key properties of 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine?
1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 230.29 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-fluoro-2-methylphenyl)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 113469674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).