5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine

C14H16FN3 — CID 114273146

IUPAC5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(C(N)c2ccccc2F)cn1
InChIInChI=1S/C14H16FN3/c1-18(2)13-8-7-10(9-17-13)14(16)11-5-3-4-6-12(11)15/h3-9,14H,16H2,1-2H3
InChIKeyVFFJHTPWXNHIOF-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.33
Rot. Bonds3

About 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine

5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine (PubChem CID 114273146) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine
PubChem CID114273146
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(C(N)c2ccccc2F)cn1
InChIInChI=1S/C14H16FN3/c1-18(2)13-8-7-10(9-17-13)14(16)11-5-3-4-6-12(11)15/h3-9,14H,16H2,1-2H3
InChIKeyVFFJHTPWXNHIOF-UHFFFAOYSA-N
XLogP2.33
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2,3-difluorophenyl)-hydrazinylmethyl]-N,N-dimethylpyridin-2-amine
CID 114273309
5-[amino-(3-methyl-2-pyridinyl)methyl]-N,N-dimethylpyridin-2-amine
CID 114273144
5-[hydrazinyl-(2-methoxyphenyl)methyl]-N,N-dimethylpyridin-2-amine
CID 114273282
5-(1-aminopropan-2-yl)-N,N-dimethylpyridin-2-amine
CID 82654185
(4-chloro-3-methylphenyl)-(2-fluorophenyl)methanamine
CID 115828038
(3,4-dimethoxyphenyl)-(2-fluorophenyl)methanamine
CID 24688761
(2-fluorophenyl)-[4-(2-methylbutan-2-yl)phenyl]methanamine
CID 66259744
(2-fluorophenyl)-(1-phenylpyrazol-4-yl)methanamine
CID 43322500
(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
CID 107288878
(2-fluorophenyl)-thiophen-3-ylmethanamine
CID 62502632
5-(chloromethyl)-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine
CID 62983613
[6-[1-(2-fluorophenyl)ethyl-methylamino]-3-pyridinyl]methanol
CID 62984853

Frequently Asked Questions

What is the IUPAC name of 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine (CID 114273146) is 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine is CN(C)c1ccc(C(N)c2ccccc2F)cn1.
What is the InChIKey of 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine?
The InChIKey is VFFJHTPWXNHIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-18(2)13-8-7-10(9-17-13)14(16)11-5-3-4-6-12(11)15/h3-9,14H,16H2,1-2H3.
What are the key properties of 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine?
5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine has a molecular weight of 245.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[amino-(2-fluorophenyl)methyl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 114273146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).