6,8-difluoro-N,2-dipropylquinolin-4-amine

C15H18F2N2 — CID 55196345

IUPAC6,8-difluoro-N,2-dipropylquinolin-4-amine
SMILESCCCNc1cc(CCC)nc2c(F)cc(F)cc12
InChIInChI=1S/C15H18F2N2/c1-3-5-11-9-14(18-6-4-2)12-7-10(16)8-13(17)15(12)19-11/h7-9H,3-6H2,1-2H3,(H,18,19)
InChIKeyXGNVKOMLXVXUGT-UHFFFAOYSA-N
MW264.32 g/mol
LogP4.29
Rot. Bonds5

About 6,8-difluoro-N,2-dipropylquinolin-4-amine

6,8-difluoro-N,2-dipropylquinolin-4-amine (PubChem CID 55196345) has the molecular formula C15H18F2N2 and a molecular weight of 264.32 g/mol. Its IUPAC name is 6,8-difluoro-N,2-dipropylquinolin-4-amine.

Molecular Properties

Compound Name6,8-difluoro-N,2-dipropylquinolin-4-amine
PubChem CID55196345
Molecular FormulaC15H18F2N2
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Name6,8-difluoro-N,2-dipropylquinolin-4-amine
SMILESCCCNc1cc(CCC)nc2c(F)cc(F)cc12
InChIInChI=1S/C15H18F2N2/c1-3-5-11-9-14(18-6-4-2)12-7-10(16)8-13(17)15(12)19-11/h7-9H,3-6H2,1-2H3,(H,18,19)
InChIKeyXGNVKOMLXVXUGT-UHFFFAOYSA-N
XLogP4.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,8-difluoro-N,2-dipropylquinolin-4-amine?
The IUPAC name of 6,8-difluoro-N,2-dipropylquinolin-4-amine (CID 55196345) is 6,8-difluoro-N,2-dipropylquinolin-4-amine.
What is the SMILES notation for 6,8-difluoro-N,2-dipropylquinolin-4-amine?
The canonical SMILES for 6,8-difluoro-N,2-dipropylquinolin-4-amine is CCCNc1cc(CCC)nc2c(F)cc(F)cc12.
What is the InChIKey of 6,8-difluoro-N,2-dipropylquinolin-4-amine?
The InChIKey is XGNVKOMLXVXUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2/c1-3-5-11-9-14(18-6-4-2)12-7-10(16)8-13(17)15(12)19-11/h7-9H,3-6H2,1-2H3,(H,18,19).
What are the key properties of 6,8-difluoro-N,2-dipropylquinolin-4-amine?
6,8-difluoro-N,2-dipropylquinolin-4-amine has a molecular weight of 264.32 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-difluoro-N,2-dipropylquinolin-4-amine is sourced from PubChem (CID 55196345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).