N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide

C16H13F3N2O2 — CID 71699078

IUPACN-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(C(F)(F)F)cc1)C1COc2ncccc21
InChIInChI=1S/C16H13F3N2O2/c17-16(18,19)11-5-3-10(4-6-11)8-21-14(22)13-9-23-15-12(13)2-1-7-20-15/h1-7,13H,8-9H2,(H,21,22)
InChIKeyAUTYGILTJMPOGA-UHFFFAOYSA-N
MW322.29 g/mol
LogP2.89
Rot. Bonds3

About N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide

N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide (PubChem CID 71699078) has the molecular formula C16H13F3N2O2 and a molecular weight of 322.29 g/mol. Its IUPAC name is N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide
PubChem CID71699078
Molecular FormulaC16H13F3N2O2
Molecular Weight322.29 g/mol
Exact Mass322.09
IUPAC NameN-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(C(F)(F)F)cc1)C1COc2ncccc21
InChIInChI=1S/C16H13F3N2O2/c17-16(18,19)11-5-3-10(4-6-11)8-21-14(22)13-9-23-15-12(13)2-1-7-20-15/h1-7,13H,8-9H2,(H,21,22)
InChIKeyAUTYGILTJMPOGA-UHFFFAOYSA-N
XLogP2.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.29
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3,3-Bis-(4-fluorophenyl)-propyl]-2-(2,2,2-trifluoro-ethoxy)-isonicotinamide
CID 44475061
2-[2-chloro-3-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239567
US11045457, Example 157
CID 146401932
US11045457, Example 209
CID 146402430
US11045457, Example 33
CID 146422009
2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239208
2-[2-chloro-3-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)propanamide
CID 71239211
N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)-2-(2,4,6-trifluorophenyl)acetamide
CID 71239239
N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)-2-[2-fluoro-3-(trifluoromethyl)phenyl]acetamide
CID 71239317
2-[3-chloro-2-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239394
2-[3-cyano-2-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239396
N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide
CID 71239419

Frequently Asked Questions

What is the IUPAC name of N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide?
The IUPAC name of N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide (CID 71699078) is N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide.
What is the SMILES notation for N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide?
The canonical SMILES for N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide is O=C(NCc1ccc(C(F)(F)F)cc1)C1COc2ncccc21.
What is the InChIKey of N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide?
The InChIKey is AUTYGILTJMPOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F3N2O2/c17-16(18,19)11-5-3-10(4-6-11)8-21-14(22)13-9-23-15-12(13)2-1-7-20-15/h1-7,13H,8-9H2,(H,21,22).
What are the key properties of N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide?
N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide has a molecular weight of 322.29 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydrofuro[2,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 71699078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).