8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline

C10H11F2NO — CID 16780862

IUPAC8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)Oc1cccc2c1NCCC2
InChIInChI=1S/C10H11F2NO/c11-10(12)14-8-5-1-3-7-4-2-6-13-9(7)8/h1,3,5,10,13H,2,4,6H2
InChIKeyHJNVCPDINIURFY-UHFFFAOYSA-N
MW199.20 g/mol
LogP2.65
Rot. Bonds2

About 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline

8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline (PubChem CID 16780862) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline
PubChem CID16780862
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)Oc1cccc2c1NCCC2
InChIInChI=1S/C10H11F2NO/c11-10(12)14-8-5-1-3-7-4-2-6-13-9(7)8/h1,3,5,10,13H,2,4,6H2
InChIKeyHJNVCPDINIURFY-UHFFFAOYSA-N
XLogP2.65
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline (CID 16780862) is 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline is FC(F)Oc1cccc2c1NCCC2.
What is the InChIKey of 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline?
The InChIKey is HJNVCPDINIURFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c11-10(12)14-8-5-1-3-7-4-2-6-13-9(7)8/h1,3,5,10,13H,2,4,6H2.
What are the key properties of 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline?
8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline has a molecular weight of 199.20 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 16780862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).