(6,8-difluoro-2-methylquinolin-4-yl)methanamine

C11H10F2N2 — CID 82507508

IUPAC(6,8-difluoro-2-methylquinolin-4-yl)methanamine
SMILESCc1cc(CN)c2cc(F)cc(F)c2n1
InChIInChI=1S/C11H10F2N2/c1-6-2-7(5-14)9-3-8(12)4-10(13)11(9)15-6/h2-4H,5,14H2,1H3
InChIKeyVZTDBRXZAMWBJU-UHFFFAOYSA-N
MW208.21 g/mol
LogP2.28
Rot. Bonds1

About (6,8-difluoro-2-methylquinolin-4-yl)methanamine

(6,8-difluoro-2-methylquinolin-4-yl)methanamine (PubChem CID 82507508) has the molecular formula C11H10F2N2 and a molecular weight of 208.21 g/mol. Its IUPAC name is (6,8-difluoro-2-methylquinolin-4-yl)methanamine.

Molecular Properties

Compound Name(6,8-difluoro-2-methylquinolin-4-yl)methanamine
PubChem CID82507508
Molecular FormulaC11H10F2N2
Molecular Weight208.21 g/mol
Exact Mass208.08
IUPAC Name(6,8-difluoro-2-methylquinolin-4-yl)methanamine
SMILESCc1cc(CN)c2cc(F)cc(F)c2n1
InChIInChI=1S/C11H10F2N2/c1-6-2-7(5-14)9-3-8(12)4-10(13)11(9)15-6/h2-4H,5,14H2,1H3
InChIKeyVZTDBRXZAMWBJU-UHFFFAOYSA-N
XLogP2.28
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6,8-difluoro-2-methylquinolin-4-yl)methanamine?
The IUPAC name of (6,8-difluoro-2-methylquinolin-4-yl)methanamine (CID 82507508) is (6,8-difluoro-2-methylquinolin-4-yl)methanamine.
What is the SMILES notation for (6,8-difluoro-2-methylquinolin-4-yl)methanamine?
The canonical SMILES for (6,8-difluoro-2-methylquinolin-4-yl)methanamine is Cc1cc(CN)c2cc(F)cc(F)c2n1.
What is the InChIKey of (6,8-difluoro-2-methylquinolin-4-yl)methanamine?
The InChIKey is VZTDBRXZAMWBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2/c1-6-2-7(5-14)9-3-8(12)4-10(13)11(9)15-6/h2-4H,5,14H2,1H3.
What are the key properties of (6,8-difluoro-2-methylquinolin-4-yl)methanamine?
(6,8-difluoro-2-methylquinolin-4-yl)methanamine has a molecular weight of 208.21 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,8-difluoro-2-methylquinolin-4-yl)methanamine is sourced from PubChem (CID 82507508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).