2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide

C12H15F4N3O — CID 106295513

IUPAC2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
SMILESCCCc1cc(C(=O)NCC(F)(F)C(F)F)cc(N)n1
InChIInChI=1S/C12H15F4N3O/c1-2-3-8-4-7(5-9(17)19-8)10(20)18-6-12(15,16)11(13)14/h4-5,11H,2-3,6H2,1H3,(H2,17,19)(H,18,20)
InChIKeyVTEBIOYHKGKJHZ-UHFFFAOYSA-N
MW293.26 g/mol
LogP2.25
Rot. Bonds6

About 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide

2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide (PubChem CID 106295513) has the molecular formula C12H15F4N3O and a molecular weight of 293.26 g/mol. Its IUPAC name is 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
PubChem CID106295513
Molecular FormulaC12H15F4N3O
Molecular Weight293.26 g/mol
Exact Mass293.12
IUPAC Name2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
SMILESCCCc1cc(C(=O)NCC(F)(F)C(F)F)cc(N)n1
InChIInChI=1S/C12H15F4N3O/c1-2-3-8-4-7(5-9(17)19-8)10(20)18-6-12(15,16)11(13)14/h4-5,11H,2-3,6H2,1H3,(H2,17,19)(H,18,20)
InChIKeyVTEBIOYHKGKJHZ-UHFFFAOYSA-N
XLogP2.25
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.26
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

2-hydrazinyl-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295650
2-amino-6-methyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 114169847
2-amino-6-propan-2-yl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295561
2-amino-N-(cyclopropylmethyl)-6-propylpyridine-4-carboxamide
CID 113380957
2-amino-N-(3-methylpentan-3-yl)-6-propylpyridine-4-carboxamide
CID 106331239
3-amino-5-methylsulfonyl-N-(2,2,3,3-tetrafluoropropyl)benzamide
CID 106289195
2-amino-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-6-propylpyridine-4-carboxamide
CID 106383344
2-hydrazinyl-6-propan-2-yl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295635
2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide
CID 116788000
3-(aminomethyl)-N-(2,2,3,3-tetrafluoropropyl)benzamide
CID 106289370
N-(2-ethoxy-2-methylpropyl)-2-hydrazinyl-6-propylpyridine-4-carboxamide
CID 114944205
2-amino-N-(3-bromo-2-methylphenyl)-6-propylpyridine-4-carboxamide
CID 107631129

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide (CID 106295513) is 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide is CCCc1cc(C(=O)NCC(F)(F)C(F)F)cc(N)n1.
What is the InChIKey of 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide?
The InChIKey is VTEBIOYHKGKJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F4N3O/c1-2-3-8-4-7(5-9(17)19-8)10(20)18-6-12(15,16)11(13)14/h4-5,11H,2-3,6H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide?
2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide has a molecular weight of 293.26 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide is sourced from PubChem (CID 106295513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).