4-(difluoromethyl)quinolin-3-amine

C10H8F2N2 — CID 178080175

IUPAC4-(difluoromethyl)quinolin-3-amine
SMILESNc1cnc2ccccc2c1C(F)F
InChIInChI=1S/C10H8F2N2/c11-10(12)9-6-3-1-2-4-8(6)14-5-7(9)13/h1-5,10H,13H2
InChIKeyGVWXYSJJYBKUJF-UHFFFAOYSA-N
MW194.18 g/mol
LogP2.75
Rot. Bonds1

About 4-(difluoromethyl)quinolin-3-amine

4-(difluoromethyl)quinolin-3-amine (PubChem CID 178080175) has the molecular formula C10H8F2N2 and a molecular weight of 194.18 g/mol. Its IUPAC name is 4-(difluoromethyl)quinolin-3-amine.

Molecular Properties

Compound Name4-(difluoromethyl)quinolin-3-amine
PubChem CID178080175
Molecular FormulaC10H8F2N2
Molecular Weight194.18 g/mol
Exact Mass194.07
IUPAC Name4-(difluoromethyl)quinolin-3-amine
SMILESNc1cnc2ccccc2c1C(F)F
InChIInChI=1S/C10H8F2N2/c11-10(12)9-6-3-1-2-4-8(6)14-5-7(9)13/h1-5,10H,13H2
InChIKeyGVWXYSJJYBKUJF-UHFFFAOYSA-N
XLogP2.75
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.18
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-aminoquinolin-4-yl)ethanol
CID 118547425
4-N-(2,2-difluoroethyl)quinoline-3,4-diamine
CID 103963516
[2-amino-2-(3-aminoquinolin-4-yl)ethyl]carbamic acid
CID 57026745
4-(3-methylbutan-2-yloxy)quinolin-3-amine
CID 113359457
4-N-[4-[(3-aminoquinolin-4-yl)amino]butyl]quinoline-3,4-diamine
CID 149004364
4-(1,1,1-trifluoropropan-2-yloxy)quinolin-3-amine
CID 113359456
4-N-(2-aminoethyl)quinoline-3,4-diamine
CID 103963227
4-N-(2-methylsulfanylphenyl)quinoline-3,4-diamine
CID 107643533
4-prop-1-en-2-ylquinolin-3-amine
CID 135324599
[3-(difluoromethyl)quinolin-4-yl]-trimethylazanium
CID 123874928
4-phenylselanylquinolin-3-amine
CID 177465835
4-(difluoromethyl)-5,6-difluoropyridin-3-amine
CID 130099519

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)quinolin-3-amine?
The IUPAC name of 4-(difluoromethyl)quinolin-3-amine (CID 178080175) is 4-(difluoromethyl)quinolin-3-amine.
What is the SMILES notation for 4-(difluoromethyl)quinolin-3-amine?
The canonical SMILES for 4-(difluoromethyl)quinolin-3-amine is Nc1cnc2ccccc2c1C(F)F.
What is the InChIKey of 4-(difluoromethyl)quinolin-3-amine?
The InChIKey is GVWXYSJJYBKUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2/c11-10(12)9-6-3-1-2-4-8(6)14-5-7(9)13/h1-5,10H,13H2.
What are the key properties of 4-(difluoromethyl)quinolin-3-amine?
4-(difluoromethyl)quinolin-3-amine has a molecular weight of 194.18 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)quinolin-3-amine is sourced from PubChem (CID 178080175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).