2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide

C18H19F3N2O3 — CID 119049112

IUPAC2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C)nc2OCC)c(C(F)(F)F)c1
InChIInChI=1S/C18H19F3N2O3/c1-4-25-12-7-9-15(14(10-12)18(19,20)21)23-16(24)13-8-6-11(3)22-17(13)26-5-2/h6-10H,4-5H2,1-3H3,(H,23,24)
InChIKeyFLSBUPPPHFUMHC-UHFFFAOYSA-N
MW368.36 g/mol
LogP4.46
Rot. Bonds6

About 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide

2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide (PubChem CID 119049112) has the molecular formula C18H19F3N2O3 and a molecular weight of 368.36 g/mol. Its IUPAC name is 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide
PubChem CID119049112
Molecular FormulaC18H19F3N2O3
Molecular Weight368.36 g/mol
Exact Mass368.13
IUPAC Name2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C)nc2OCC)c(C(F)(F)F)c1
InChIInChI=1S/C18H19F3N2O3/c1-4-25-12-7-9-15(14(10-12)18(19,20)21)23-16(24)13-8-6-11(3)22-17(13)26-5-2/h6-10H,4-5H2,1-3H3,(H,23,24)
InChIKeyFLSBUPPPHFUMHC-UHFFFAOYSA-N
XLogP4.46
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.36
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-3-[4-ethoxy-2-(trifluoromethyl)phenyl]urea
CID 47420595
1-[4-ethoxy-2-(trifluoromethyl)phenyl]-3-(2-phenylethyl)urea
CID 60588996
1-[4-ethoxy-2-(trifluoromethyl)phenyl]-3-[2-(4-fluorophenyl)ethyl]urea
CID 60588883
N-[4-iodo-2-(trifluoromethyl)phenyl]-4-propoxybenzamide
CID 3657897
1-[4-ethoxy-2-(trifluoromethyl)phenyl]-3-[2-(furan-2-yl)-2-hydroxyethyl]urea
CID 86847008
3-butoxy-N-[4-iodo-2-(trifluoromethyl)phenyl]benzamide
CID 3875364
4-butoxy-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 4512796
2-[[4-ethoxy-2-(trifluoromethyl)phenyl]carbamoyl-methylamino]-N-(2-ethylphenyl)acetamide
CID 60589161
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647
2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
CID 106685543
1-(2,4-diethoxyphenyl)-2,2,2-trifluoroethanone
CID 83952962
1-[4-ethoxy-2-(trifluoromethyl)phenyl]-3-[3-(4-methylpiperidin-1-yl)propyl]urea
CID 60589064

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide (CID 119049112) is 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide is CCOc1ccc(NC(=O)c2ccc(C)nc2OCC)c(C(F)(F)F)c1.
What is the InChIKey of 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide?
The InChIKey is FLSBUPPPHFUMHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N2O3/c1-4-25-12-7-9-15(14(10-12)18(19,20)21)23-16(24)13-8-6-11(3)22-17(13)26-5-2/h6-10H,4-5H2,1-3H3,(H,23,24).
What are the key properties of 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide?
2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide has a molecular weight of 368.36 g/mol, XLogP of 4.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[4-ethoxy-2-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 119049112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).