6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide

C10H12F3N3O — CID 63227522

IUPAC6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCCC(F)(F)F)cn1
InChIInChI=1S/C10H12F3N3O/c1-14-8-3-2-7(6-16-8)9(17)15-5-4-10(11,12)13/h2-3,6H,4-5H2,1H3,(H,14,16)(H,15,17)
InChIKeyZBYKVFIYELXXNP-UHFFFAOYSA-N
MW247.22 g/mol
LogP1.81
Rot. Bonds4

About 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide

6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide (PubChem CID 63227522) has the molecular formula C10H12F3N3O and a molecular weight of 247.22 g/mol. Its IUPAC name is 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
PubChem CID63227522
Molecular FormulaC10H12F3N3O
Molecular Weight247.22 g/mol
Exact Mass247.09
IUPAC Name6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCCC(F)(F)F)cn1
InChIInChI=1S/C10H12F3N3O/c1-14-8-3-2-7(6-16-8)9(17)15-5-4-10(11,12)13/h2-3,6H,4-5H2,1H3,(H,14,16)(H,15,17)
InChIKeyZBYKVFIYELXXNP-UHFFFAOYSA-N
XLogP1.81
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(methylamino)-N-(5,5,5-trifluoropentyl)pyridine-3-carboxamide
CID 115522150
6-bromo-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
CID 66465126
6-(methylamino)-N-[2-(methylsulfamoyl)ethyl]pyridine-3-carboxamide
CID 106342502
N-[2-(2-fluorophenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 62171019
N-(cyanomethyl)-6-(methylamino)pyridine-3-carboxamide
CID 126986999
N-(2,3-dimethylbutyl)-6-(methylamino)pyridine-3-carboxamide
CID 64583359
N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
CID 91045435
6-bromo-N-(4,4,4-trifluorobutyl)pyridine-3-carboxamide
CID 79420880
6-(methylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 62186448
N-[3-(butan-2-ylamino)-3-oxopropyl]-6-(methylamino)pyridine-3-carboxamide
CID 62177053
N-[2-(dimethylamino)propyl]-6-(methylamino)pyridine-3-carboxamide
CID 62175314
N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 107261353

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide (CID 63227522) is 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide is CNc1ccc(C(=O)NCCC(F)(F)F)cn1.
What is the InChIKey of 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide?
The InChIKey is ZBYKVFIYELXXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O/c1-14-8-3-2-7(6-16-8)9(17)15-5-4-10(11,12)13/h2-3,6H,4-5H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide?
6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide has a molecular weight of 247.22 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide is sourced from PubChem (CID 63227522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).