1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine

C16H14FN3 — CID 107356910

IUPAC1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cnc2ccccc2n1
InChIInChI=1S/C16H14FN3/c1-18-16(11-6-8-12(17)9-7-11)15-10-19-13-4-2-3-5-14(13)20-15/h2-10,16,18H,1H3
InChIKeyVUISWXRXKHQZFL-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.08
Rot. Bonds3

About 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine

1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine (PubChem CID 107356910) has the molecular formula C16H14FN3 and a molecular weight of 267.31 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
PubChem CID107356910
Molecular FormulaC16H14FN3
Molecular Weight267.31 g/mol
Exact Mass267.12
IUPAC Name1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cnc2ccccc2n1
InChIInChI=1S/C16H14FN3/c1-18-16(11-6-8-12(17)9-7-11)15-10-19-13-4-2-3-5-14(13)20-15/h2-10,16,18H,1H3
InChIKeyVUISWXRXKHQZFL-UHFFFAOYSA-N
XLogP3.08
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-difluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107357086
1-(3,5-dimethylphenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107356945
1-(4-fluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712823
1-(2,3-difluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107357167
1-(3-methoxyphenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107356903
1-(4-chlorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712635
1,1-bis(4-fluorophenyl)-N-methylmethanamine
CID 22660961
[(3,4-difluorophenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357865
1-(4-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105087924
N-methyl-1-quinoxalin-2-ylprop-2-en-1-amine
CID 107357254
1-(4-fluorophenyl)-N-methyl-1-quinoxalin-6-ylmethanamine
CID 62850785
1-(4-fluorophenyl)-N-methyl-1-(2-phenyltriazol-4-yl)methanamine
CID 105088239

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine?
The IUPAC name of 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine (CID 107356910) is 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine?
The canonical SMILES for 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine is CNC(c1ccc(F)cc1)c1cnc2ccccc2n1.
What is the InChIKey of 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine?
The InChIKey is VUISWXRXKHQZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3/c1-18-16(11-6-8-12(17)9-7-11)15-10-19-13-4-2-3-5-14(13)20-15/h2-10,16,18H,1H3.
What are the key properties of 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine?
1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine has a molecular weight of 267.31 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine is sourced from PubChem (CID 107356910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).