2-(difluoromethyl)-6,7-difluoroquinolin-4-amine

C10H6F4N2 — CID 62890537

IUPAC2-(difluoromethyl)-6,7-difluoroquinolin-4-amine
SMILESNc1cc(C(F)F)nc2cc(F)c(F)cc12
InChIInChI=1S/C10H6F4N2/c11-5-1-4-7(15)3-9(10(13)14)16-8(4)2-6(5)12/h1-3,10H,(H2,15,16)
InChIKeyUQWCFWAQRXTBHB-UHFFFAOYSA-N
MW230.16 g/mol
LogP3.03
Rot. Bonds1

About 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine

2-(difluoromethyl)-6,7-difluoroquinolin-4-amine (PubChem CID 62890537) has the molecular formula C10H6F4N2 and a molecular weight of 230.16 g/mol. Its IUPAC name is 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-6,7-difluoroquinolin-4-amine
PubChem CID62890537
Molecular FormulaC10H6F4N2
Molecular Weight230.16 g/mol
Exact Mass230.05
IUPAC Name2-(difluoromethyl)-6,7-difluoroquinolin-4-amine
SMILESNc1cc(C(F)F)nc2cc(F)c(F)cc12
InChIInChI=1S/C10H6F4N2/c11-5-1-4-7(15)3-9(10(13)14)16-8(4)2-6(5)12/h1-3,10H,(H2,15,16)
InChIKeyUQWCFWAQRXTBHB-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.16
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine?
The IUPAC name of 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine (CID 62890537) is 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine.
What is the SMILES notation for 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine?
The canonical SMILES for 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine is Nc1cc(C(F)F)nc2cc(F)c(F)cc12.
What is the InChIKey of 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine?
The InChIKey is UQWCFWAQRXTBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F4N2/c11-5-1-4-7(15)3-9(10(13)14)16-8(4)2-6(5)12/h1-3,10H,(H2,15,16).
What are the key properties of 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine?
2-(difluoromethyl)-6,7-difluoroquinolin-4-amine has a molecular weight of 230.16 g/mol, XLogP of 3.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6,7-difluoroquinolin-4-amine is sourced from PubChem (CID 62890537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).