4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine

C8H5F3N2O — CID 130119816

IUPAC4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine
SMILESFC(F)(F)Oc1nccc2[nH]ccc12
InChIInChI=1S/C8H5F3N2O/c9-8(10,11)14-7-5-1-3-12-6(5)2-4-13-7/h1-4,12H
InChIKeyQRLAZLODLDAESL-UHFFFAOYSA-N
MW202.14 g/mol
LogP2.46
Rot. Bonds1

About 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine

4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine (PubChem CID 130119816) has the molecular formula C8H5F3N2O and a molecular weight of 202.14 g/mol. Its IUPAC name is 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine
PubChem CID130119816
Molecular FormulaC8H5F3N2O
Molecular Weight202.14 g/mol
Exact Mass202.04
IUPAC Name4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine
SMILESFC(F)(F)Oc1nccc2[nH]ccc12
InChIInChI=1S/C8H5F3N2O/c9-8(10,11)14-7-5-1-3-12-6(5)2-4-13-7/h1-4,12H
InChIKeyQRLAZLODLDAESL-UHFFFAOYSA-N
XLogP2.46
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.14
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine-2-carboxylic acid
CID 171137802
4-[4-(4,6-dimethylpyrimidin-5-yl)-2,3-difluorophenoxy]-1H-pyrrolo[3,2-c]pyridine
CID 86767100
3-bromo-2-(trifluoromethoxy)pyridin-4-amine
CID 130088966
4-(1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridine
CID 168849141
2-(1H-pyrrolo[3,2-c]pyridin-4-yl)acetamide
CID 89240037
4-chloro-2-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 118817072
4-iodo-2-methoxy-3-(trifluoromethoxy)pyridine
CID 118833057
4-(1,1-difluoroethyl)-1H-indole
CID 145206515
[4-chloro-2-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130089738
[4-iodo-2-(trifluoromethoxy)-3-pyridinyl]methanol
CID 130092556
[4-methyl-2-(trifluoromethoxy)-3-pyridinyl]methanol
CID 130093342
4-(trifluoromethoxy)quinoline
CID 118835416

Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine?
The IUPAC name of 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine (CID 130119816) is 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine?
The canonical SMILES for 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine is FC(F)(F)Oc1nccc2[nH]ccc12.
What is the InChIKey of 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine?
The InChIKey is QRLAZLODLDAESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F3N2O/c9-8(10,11)14-7-5-1-3-12-6(5)2-4-13-7/h1-4,12H.
What are the key properties of 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine?
4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine has a molecular weight of 202.14 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethoxy)-1H-pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 130119816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).