5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide

C16H18FN3O — CID 109195204

IUPAC5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide
SMILESCC(C)(C)Nc1ccc(C(=O)Nc2ccccc2F)nc1
InChIInChI=1S/C16H18FN3O/c1-16(2,3)20-11-8-9-14(18-10-11)15(21)19-13-7-5-4-6-12(13)17/h4-10,20H,1-3H3,(H,19,21)
InChIKeyJLUMVVXGTLQLHF-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.68
Rot. Bonds3

About 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide

5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide (PubChem CID 109195204) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide
PubChem CID109195204
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide
SMILESCC(C)(C)Nc1ccc(C(=O)Nc2ccccc2F)nc1
InChIInChI=1S/C16H18FN3O/c1-16(2,3)20-11-8-9-14(18-10-11)15(21)19-13-7-5-4-6-12(13)17/h4-10,20H,1-3H3,(H,19,21)
InChIKeyJLUMVVXGTLQLHF-UHFFFAOYSA-N
XLogP3.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109180924
N-tert-butyl-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109195085
N-(2-fluorophenyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109198647
N-(2-fluorophenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190308
5-(2,6-dichloroanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109198867
5-(tert-butylamino)-N-(4-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 109195211
5-(tert-butylamino)-N-[4-chloro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109195266
N-[5-(tert-butylamino)-2-pyridinyl]-2-fluorobenzamide
CID 113029972
5-ethoxy-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 146277110
5-(tert-butylamino)-N-(4-tert-butylphenyl)pyridine-2-carboxamide
CID 109195203
N-(2-bromo-4-methylphenyl)-5-(tert-butylamino)pyridine-2-carboxamide
CID 109195255
5-(tert-butylamino)-N-(2-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 109195247

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide (CID 109195204) is 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide is CC(C)(C)Nc1ccc(C(=O)Nc2ccccc2F)nc1.
What is the InChIKey of 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is JLUMVVXGTLQLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-16(2,3)20-11-8-9-14(18-10-11)15(21)19-13-7-5-4-6-12(13)17/h4-10,20H,1-3H3,(H,19,21).
What are the key properties of 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide?
5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide has a molecular weight of 287.34 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109195204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).