[2-methoxy-5-(trifluoromethoxy)phenyl]azanide

C8H7F3NO2- — CID 158966007

IUPAC[2-methoxy-5-(trifluoromethoxy)phenyl]azanide
SMILESCOc1ccc(OC(F)(F)F)cc1[NH-]
InChIInChI=1S/C8H7F3NO2/c1-13-7-3-2-5(4-6(7)12)14-8(9,10)11/h2-4,12H,1H3/q-1
InChIKeyJNFCFFHCFLCBIV-UHFFFAOYSA-N
MW206.14 g/mol
LogP3.28
Rot. Bonds2

About [2-methoxy-5-(trifluoromethoxy)phenyl]azanide

[2-methoxy-5-(trifluoromethoxy)phenyl]azanide (PubChem CID 158966007) has the molecular formula C8H7F3NO2- and a molecular weight of 206.14 g/mol. Its IUPAC name is [2-methoxy-5-(trifluoromethoxy)phenyl]azanide.

Molecular Properties

Compound Name[2-methoxy-5-(trifluoromethoxy)phenyl]azanide
PubChem CID158966007
Molecular FormulaC8H7F3NO2-
Molecular Weight206.14 g/mol
Exact Mass206.04
IUPAC Name[2-methoxy-5-(trifluoromethoxy)phenyl]azanide
SMILESCOc1ccc(OC(F)(F)F)cc1[NH-]
InChIInChI=1S/C8H7F3NO2/c1-13-7-3-2-5(4-6(7)12)14-8(9,10)11/h2-4,12H,1H3/q-1
InChIKeyJNFCFFHCFLCBIV-UHFFFAOYSA-N
XLogP3.28
TPSA42.26 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.14
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dimethoxy-4-(trifluoromethoxy)benzene
CID 58342037
1-iodo-2-methoxy-4-(trifluoromethoxy)benzene
CID 53415972
(1R)-1-[2-methoxy-5-(trifluoromethoxy)phenyl]ethanamine;hydrochloride
CID 171208716
methyl 2-[2-methoxy-5-(trifluoromethoxy)phenyl]acetate
CID 170997187
(NZ)-N-[[2-methoxy-5-(trifluoromethoxy)phenyl]methylidene]hydroxylamine
CID 26596685
3-[2-methoxy-5-(trifluoromethoxy)phenyl]propanal
CID 134621524
1-methoxy-2-[(E)-2-phenylethenyl]-4-(trifluoromethoxy)benzene
CID 141369705
(2R)-2-amino-2-[2-methoxy-5-(trifluoromethoxy)phenyl]ethanol
CID 66515505
2-methoxy-1-nitro-4-(trifluoromethoxy)benzene
CID 53417127
(2S,3S)-3-amino-1,1,1-trifluoro-3-[2-methoxy-5-(trifluoromethoxy)phenyl]propan-2-ol
CID 171269353
4-chloro-1-methoxy-2-[4-(trifluoromethoxy)phenyl]benzene
CID 134629678
(R)-(3,4-dimethoxyphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171246015

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-5-(trifluoromethoxy)phenyl]azanide?
The IUPAC name of [2-methoxy-5-(trifluoromethoxy)phenyl]azanide (CID 158966007) is [2-methoxy-5-(trifluoromethoxy)phenyl]azanide.
What is the SMILES notation for [2-methoxy-5-(trifluoromethoxy)phenyl]azanide?
The canonical SMILES for [2-methoxy-5-(trifluoromethoxy)phenyl]azanide is COc1ccc(OC(F)(F)F)cc1[NH-].
What is the InChIKey of [2-methoxy-5-(trifluoromethoxy)phenyl]azanide?
The InChIKey is JNFCFFHCFLCBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3NO2/c1-13-7-3-2-5(4-6(7)12)14-8(9,10)11/h2-4,12H,1H3/q-1.
What are the key properties of [2-methoxy-5-(trifluoromethoxy)phenyl]azanide?
[2-methoxy-5-(trifluoromethoxy)phenyl]azanide has a molecular weight of 206.14 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-5-(trifluoromethoxy)phenyl]azanide is sourced from PubChem (CID 158966007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).