5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide

C16H16F3NO4 — CID 78882053

IUPAC5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide
SMILESCOCc1ccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)o1
InChIInChI=1S/C16H16F3NO4/c1-22-10-13-6-7-14(23-13)15(21)20-9-8-11-2-4-12(5-3-11)24-16(17,18)19/h2-7H,8-10H2,1H3,(H,20,21)
InChIKeyUCVKRGNLEULXML-UHFFFAOYSA-N
MW343.30 g/mol
LogP3.30
Rot. Bonds7

About 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide

5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide (PubChem CID 78882053) has the molecular formula C16H16F3NO4 and a molecular weight of 343.30 g/mol. Its IUPAC name is 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide
PubChem CID78882053
Molecular FormulaC16H16F3NO4
Molecular Weight343.30 g/mol
Exact Mass343.10
IUPAC Name5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide
SMILESCOCc1ccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)o1
InChIInChI=1S/C16H16F3NO4/c1-22-10-13-6-7-14(23-13)15(21)20-9-8-11-2-4-12(5-3-11)24-16(17,18)19/h2-7H,8-10H2,1H3,(H,20,21)
InChIKeyUCVKRGNLEULXML-UHFFFAOYSA-N
XLogP3.30
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(methoxymethyl)-N-[2-(methylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119500596
5-[(4-fluorophenoxy)methyl]-N-[2-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 55344956
N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide
CID 78874120
N-[2-(ethylamino)ethyl]-5-(methoxymethyl)furan-2-carboxamide;hydrochloride
CID 119505332
5-(methoxymethyl)-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]furan-2-carboxamide
CID 86918391
N-[2-[4-(trifluoromethoxy)phenyl]ethyl]pyrazine-2-carboxamide
CID 47043769
4-methylsulfonyl-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]benzamide
CID 47043794
5-(methoxymethyl)-N-(3-propan-2-yloxypropyl)furan-2-carboxamide
CID 78827233
5-(methoxymethyl)-N-(7-methyloctyl)furan-2-carboxamide
CID 78847305
1-[2-(4-methoxyphenyl)ethyl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 55696660
5-(methoxymethyl)-N-[2-oxo-2-(propylamino)ethyl]furan-2-carboxamide
CID 78827647
5-[[3-[4-(trifluoromethoxy)phenyl]propanoylamino]methyl]furan-2-carboxylic acid
CID 119246153

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide?
The IUPAC name of 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide (CID 78882053) is 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide?
The canonical SMILES for 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide is COCc1ccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)o1.
What is the InChIKey of 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide?
The InChIKey is UCVKRGNLEULXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F3NO4/c1-22-10-13-6-7-14(23-13)15(21)20-9-8-11-2-4-12(5-3-11)24-16(17,18)19/h2-7H,8-10H2,1H3,(H,20,21).
What are the key properties of 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide?
5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide has a molecular weight of 343.30 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 78882053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).