N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide

C17H16F3N3O5 — CID 24586582

IUPACN-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)CNC(=O)c1ccco1)NCc1ccccc1OC(F)(F)F
InChIInChI=1S/C17H16F3N3O5/c18-17(19,20)28-12-5-2-1-4-11(12)8-21-14(24)9-22-15(25)10-23-16(26)13-6-3-7-27-13/h1-7H,8-10H2,(H,21,24)(H,22,25)(H,23,26)
InChIKeyUOIWSOKOPQBAID-UHFFFAOYSA-N
MW399.33 g/mol
LogP1.34
Rot. Bonds8

About N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide

N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide (PubChem CID 24586582) has the molecular formula C17H16F3N3O5 and a molecular weight of 399.33 g/mol. Its IUPAC name is N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide
PubChem CID24586582
Molecular FormulaC17H16F3N3O5
Molecular Weight399.33 g/mol
Exact Mass399.10
IUPAC NameN-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)CNC(=O)c1ccco1)NCc1ccccc1OC(F)(F)F
InChIInChI=1S/C17H16F3N3O5/c18-17(19,20)28-12-5-2-1-4-11(12)8-21-14(24)9-22-15(25)10-23-16(26)13-6-3-7-27-13/h1-7H,8-10H2,(H,21,24)(H,22,25)(H,23,26)
InChIKeyUOIWSOKOPQBAID-UHFFFAOYSA-N
XLogP1.34
TPSA109.67 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.33
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide with MolForge

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Related Compounds

N-[3-oxo-3-[[2-(trifluoromethoxy)phenyl]methylamino]propyl]furan-2-carboxamide
CID 17464973
N-[(2S)-1-oxo-3-phenyl-1-[[2-(trifluoromethoxy)phenyl]methylamino]propan-2-yl]furan-2-carboxamide
CID 34553727
2-iodo-N-[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]benzamide
CID 34321952
2-(ethylamino)-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 60703728
2-(propan-2-ylamino)-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 60703769
2-[[N-ethyl-N'-[[2-(trifluoromethoxy)phenyl]methyl]carbamimidoyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 111847779
N-[(2-ethoxyphenyl)methyl]furan-2-carboxamide
CID 28635209
4-chloro-N-[[2-(trifluoromethoxy)phenyl]methyl]butanamide
CID 63309225
3-acetamido-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide
CID 9451822
N-[[2-[(2-methylpropan-2-yl)oxy]phenyl]methyl]-2-phenylacetamide
CID 110442352
N-(naphthalen-1-ylmethyl)furan-2-carboxamide
CID 60675809
2-(2-chloro-6-fluorophenyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 26012483

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide (CID 24586582) is N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide is O=C(CNC(=O)CNC(=O)c1ccco1)NCc1ccccc1OC(F)(F)F.
What is the InChIKey of N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide?
The InChIKey is UOIWSOKOPQBAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3N3O5/c18-17(19,20)28-12-5-2-1-4-11(12)8-21-14(24)9-22-15(25)10-23-16(26)13-6-3-7-27-13/h1-7H,8-10H2,(H,21,24)(H,22,25)(H,23,26).
What are the key properties of N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide?
N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide has a molecular weight of 399.33 g/mol, XLogP of 1.34, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[2-oxo-2-[[2-(trifluoromethoxy)phenyl]methylamino]ethyl]amino]ethyl]furan-2-carboxamide is sourced from PubChem (CID 24586582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).