3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide

C14H14FN3O — CID 105069177

IUPAC3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1N)c1ccccc1F
InChIInChI=1S/C14H14FN3O/c1-2-18(13-6-4-3-5-11(13)15)14(19)10-7-8-17-9-12(10)16/h3-9H,2,16H2,1H3
InChIKeyBEYKYOPENHAPGX-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.47
Rot. Bonds3

About 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide

3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide (PubChem CID 105069177) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide
PubChem CID105069177
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1N)c1ccccc1F
InChIInChI=1S/C14H14FN3O/c1-2-18(13-6-4-3-5-11(13)15)14(19)10-7-8-17-9-12(10)16/h3-9H,2,16H2,1H3
InChIKeyBEYKYOPENHAPGX-UHFFFAOYSA-N
XLogP2.47
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 ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide (CID 105069177) is 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide is CCN(C(=O)c1ccncc1N)c1ccccc1F.
What is the InChIKey of 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide?
The InChIKey is BEYKYOPENHAPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-2-18(13-6-4-3-5-11(13)15)14(19)10-7-8-17-9-12(10)16/h3-9H,2,16H2,1H3.
What are the key properties of 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide?
3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide has a molecular weight of 259.28 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 105069177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).