6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide

C12H14F3N3O — CID 106218176

IUPAC6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)NC2(C(F)(F)F)CC2)cn1
InChIInChI=1S/C12H14F3N3O/c1-2-16-9-4-3-8(7-17-9)10(19)18-11(5-6-11)12(13,14)15/h3-4,7H,2,5-6H2,1H3,(H,16,17)(H,18,19)
InChIKeyLFCFXOSCXYAIOS-UHFFFAOYSA-N
MW273.26 g/mol
LogP2.34
Rot. Bonds4

About 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide

6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide (PubChem CID 106218176) has the molecular formula C12H14F3N3O and a molecular weight of 273.26 g/mol. Its IUPAC name is 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide
PubChem CID106218176
Molecular FormulaC12H14F3N3O
Molecular Weight273.26 g/mol
Exact Mass273.11
IUPAC Name6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)NC2(C(F)(F)F)CC2)cn1
InChIInChI=1S/C12H14F3N3O/c1-2-16-9-4-3-8(7-17-9)10(19)18-11(5-6-11)12(13,14)15/h3-4,7H,2,5-6H2,1H3,(H,16,17)(H,18,19)
InChIKeyLFCFXOSCXYAIOS-UHFFFAOYSA-N
XLogP2.34
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 60732249
N-cyclobutyl-6-(ethylamino)pyridine-3-carboxamide
CID 62415039
2-(ethylamino)-5-fluoro-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide
CID 106218206
N-cyclooctyl-6-(ethylamino)pyridine-3-carboxamide
CID 62171358
6-(ethylamino)-N-(4-methylcyclohexyl)pyridine-3-carboxamide
CID 62173346
N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide
CID 64731574
6-(ethylamino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 62166937
6-(ethylamino)-N-(4-iodophenyl)pyridine-3-carboxamide
CID 62166329
N-ethyl-6-[(1-ethylcyclopropyl)methylamino]pyridine-3-carboxamide
CID 133338368
N-(3,5-dichloro-4-fluorophenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 107578414
6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 62171187
6-(ethylamino)-N-(1-phenylethyl)pyridine-3-carboxamide
CID 62165290

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide (CID 106218176) is 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide is CCNc1ccc(C(=O)NC2(C(F)(F)F)CC2)cn1.
What is the InChIKey of 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide?
The InChIKey is LFCFXOSCXYAIOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3N3O/c1-2-16-9-4-3-8(7-17-9)10(19)18-11(5-6-11)12(13,14)15/h3-4,7H,2,5-6H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide?
6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide has a molecular weight of 273.26 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide is sourced from PubChem (CID 106218176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).