N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide

C17H15F2N5O3 — CID 46633898

IUPACN-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide
SMILESCC(Oc1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C17H15F2N5O3/c1-11(16(25)21-14-4-2-3-5-15(14)27-17(18)19)26-13-8-6-12(7-9-13)24-10-20-22-23-24/h2-11,17H,1H3,(H,21,25)
InChIKeyDSLIBUBXNPQRSR-UHFFFAOYSA-N
MW375.34 g/mol
LogP2.67
Rot. Bonds7

About N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide

N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide (PubChem CID 46633898) has the molecular formula C17H15F2N5O3 and a molecular weight of 375.34 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide
PubChem CID46633898
Molecular FormulaC17H15F2N5O3
Molecular Weight375.34 g/mol
Exact Mass375.11
IUPAC NameN-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide
SMILESCC(Oc1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C17H15F2N5O3/c1-11(16(25)21-14-4-2-3-5-15(14)27-17(18)19)26-13-8-6-12(7-9-13)24-10-20-22-23-24/h2-11,17H,1H3,(H,21,25)
InChIKeyDSLIBUBXNPQRSR-UHFFFAOYSA-N
XLogP2.67
TPSA91.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide
CID 8946649
(2S)-N-(2-phenylsulfanylphenyl)-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 9292348
N-(4-acetylphenyl)-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 42903595
N-(2-methoxydibenzofuran-3-yl)-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 47004283
N-[2-(difluoromethoxy)phenyl]-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 7768469
2-[4-(tetrazol-1-yl)phenoxy]propanoic acid
CID 6485344
(2S)-N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]propanamide
CID 7705759
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methylphenoxy)propanoate
CID 46622069
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methoxyphenoxy)propanoate
CID 55518336
[(2S)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl] 4-(tetrazol-1-yl)benzoate
CID 8953144
(2S)-N-(4-fluorophenyl)-2-[3-(tetrazol-1-yl)phenoxy]propanamide
CID 7705781
N-cycloheptyl-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 46633897

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide (CID 46633898) is N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide is CC(Oc1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide?
The InChIKey is DSLIBUBXNPQRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N5O3/c1-11(16(25)21-14-4-2-3-5-15(14)27-17(18)19)26-13-8-6-12(7-9-13)24-10-20-22-23-24/h2-11,17H,1H3,(H,21,25).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide?
N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide has a molecular weight of 375.34 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide is sourced from PubChem (CID 46633898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).