N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide

C16H11F3N2O3S — CID 10177047

IUPACN-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide
SMILESCNC(=O)c1cc2c(Oc3ccc(OC(F)(F)F)cc3)cncc2s1
InChIInChI=1S/C16H11F3N2O3S/c1-20-15(22)13-6-11-12(7-21-8-14(11)25-13)23-9-2-4-10(5-3-9)24-16(17,18)19/h2-8H,1H3,(H,20,22)
InChIKeyIFXVYTRFRFAZEE-UHFFFAOYSA-N
MW368.34 g/mol
LogP4.35
Rot. Bonds4

About N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide

N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide (PubChem CID 10177047) has the molecular formula C16H11F3N2O3S and a molecular weight of 368.34 g/mol. Its IUPAC name is N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide
PubChem CID10177047
Molecular FormulaC16H11F3N2O3S
Molecular Weight368.34 g/mol
Exact Mass368.04
IUPAC NameN-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide
SMILESCNC(=O)c1cc2c(Oc3ccc(OC(F)(F)F)cc3)cncc2s1
InChIInChI=1S/C16H11F3N2O3S/c1-20-15(22)13-6-11-12(7-21-8-14(11)25-13)23-9-2-4-10(5-3-9)24-16(17,18)19/h2-8H,1H3,(H,20,22)
InChIKeyIFXVYTRFRFAZEE-UHFFFAOYSA-N
XLogP4.35
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.34
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide (CID 10177047) is N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide is CNC(=O)c1cc2c(Oc3ccc(OC(F)(F)F)cc3)cncc2s1.
What is the InChIKey of N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is IFXVYTRFRFAZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3N2O3S/c1-20-15(22)13-6-11-12(7-21-8-14(11)25-13)23-9-2-4-10(5-3-9)24-16(17,18)19/h2-8H,1H3,(H,20,22).
What are the key properties of N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide?
N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 368.34 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[4-(trifluoromethoxy)phenoxy]thieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 10177047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).