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

C14H14FN3O — CID 62238970

IUPAC6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1cccc(N)n1)c1cccc(F)c1
InChIInChI=1S/C14H14FN3O/c1-2-18(11-6-3-5-10(15)9-11)14(19)12-7-4-8-13(16)17-12/h3-9H,2H2,1H3,(H2,16,17)
InChIKeyINTYNSIHWOHWPR-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.47
Rot. Bonds3

About 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide

6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide (PubChem CID 62238970) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide
PubChem CID62238970
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1cccc(N)n1)c1cccc(F)c1
InChIInChI=1S/C14H14FN3O/c1-2-18(11-6-3-5-10(15)9-11)14(19)12-7-4-8-13(16)17-12/h3-9H,2H2,1H3,(H2,16,17)
InChIKeyINTYNSIHWOHWPR-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 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide (CID 62238970) is 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide is CCN(C(=O)c1cccc(N)n1)c1cccc(F)c1.
What is the InChIKey of 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is INTYNSIHWOHWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-2-18(11-6-3-5-10(15)9-11)14(19)12-7-4-8-13(16)17-12/h3-9H,2H2,1H3,(H2,16,17).
What are the key properties of 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide?
6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-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 6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62238970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).