3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide

C14H14FN3O — CID 104741078

IUPAC3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
SMILESCN(Cc1ccccc1F)C(=O)c1ncccc1N
InChIInChI=1S/C14H14FN3O/c1-18(9-10-5-2-3-6-11(10)15)14(19)13-12(16)7-4-8-17-13/h2-8H,9,16H2,1H3
InChIKeyQPUACPPIWIWKHH-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.08
Rot. Bonds3

About 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide

3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide (PubChem CID 104741078) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
PubChem CID104741078
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
SMILESCN(Cc1ccccc1F)C(=O)c1ncccc1N
InChIInChI=1S/C14H14FN3O/c1-18(9-10-5-2-3-6-11(10)15)14(19)13-12(16)7-4-8-17-13/h2-8H,9,16H2,1H3
InChIKeyQPUACPPIWIWKHH-UHFFFAOYSA-N
XLogP2.08
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-hydroxy-N-methylpyridine-2-carboxamide
CID 130884472
2-[(3-aminopyridine-2-carbonyl)-methylamino]acetic acid
CID 112704117
6-amino-3-chloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 62160447
3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 113447596
3-amino-N-methyl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 104741052
3-amino-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741521
N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 60628244
N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
CID 134057045
3-amino-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide
CID 104742351
3-amino-N-[(3-chlorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741524
N-[(2-aminophenyl)methyl]-2-(2-fluorophenyl)-N-methylacetamide
CID 43458424
2-chloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-4-carboxamide
CID 60692943

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide (CID 104741078) is 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide is CN(Cc1ccccc1F)C(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide?
The InChIKey is QPUACPPIWIWKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-18(9-10-5-2-3-6-11(10)15)14(19)13-12(16)7-4-8-17-13/h2-8H,9,16H2,1H3.
What are the key properties of 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide?
3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide has a molecular weight of 259.28 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 104741078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).