8-fluoro-4-propan-2-ylquinolin-3-amine

C12H13FN2 — CID 105456210

IUPAC8-fluoro-4-propan-2-ylquinolin-3-amine
SMILESCC(C)c1c(N)cnc2c(F)cccc12
InChIInChI=1S/C12H13FN2/c1-7(2)11-8-4-3-5-9(13)12(8)15-6-10(11)14/h3-7H,14H2,1-2H3
InChIKeyOIFGLVAERUJLHN-UHFFFAOYSA-N
MW204.25 g/mol
LogP3.08
Rot. Bonds1

About 8-fluoro-4-propan-2-ylquinolin-3-amine

8-fluoro-4-propan-2-ylquinolin-3-amine (PubChem CID 105456210) has the molecular formula C12H13FN2 and a molecular weight of 204.25 g/mol. Its IUPAC name is 8-fluoro-4-propan-2-ylquinolin-3-amine.

Molecular Properties

Compound Name8-fluoro-4-propan-2-ylquinolin-3-amine
PubChem CID105456210
Molecular FormulaC12H13FN2
Molecular Weight204.25 g/mol
Exact Mass204.11
IUPAC Name8-fluoro-4-propan-2-ylquinolin-3-amine
SMILESCC(C)c1c(N)cnc2c(F)cccc12
InChIInChI=1S/C12H13FN2/c1-7(2)11-8-4-3-5-9(13)12(8)15-6-10(11)14/h3-7H,14H2,1-2H3
InChIKeyOIFGLVAERUJLHN-UHFFFAOYSA-N
XLogP3.08
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-4-propan-2-ylquinolin-3-amine
CID 105476881
8-fluoro-4-propan-2-ylisoquinolin-1-amine
CID 115063353
6-chloro-4-propan-2-ylquinolin-3-amine
CID 105476883
1-(7-fluoro-2H-indazol-3-yl)-2-methylpropan-1-amine
CID 112716018
8-fluoro-2-methyl-4-propan-2-ylquinazoline
CID 139473937
1-(3-aminoquinolin-4-yl)ethanol
CID 118547425
3-fluoro-2-[(1R)-1-(methylamino)ethyl]aniline
CID 130738450
1-(8-fluoro-2-propan-2-ylquinolin-4-yl)ethanamine
CID 82448872
1-(5-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)ethanamine
CID 82451087
8-fluoro-N-(4-propan-2-ylphenyl)quinazolin-4-amine
CID 110434658
4-methyl-8-(trifluoromethyl)quinolin-3-amine
CID 105483666
4-(difluoromethyl)quinolin-3-amine
CID 178080175

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-4-propan-2-ylquinolin-3-amine?
The IUPAC name of 8-fluoro-4-propan-2-ylquinolin-3-amine (CID 105456210) is 8-fluoro-4-propan-2-ylquinolin-3-amine.
What is the SMILES notation for 8-fluoro-4-propan-2-ylquinolin-3-amine?
The canonical SMILES for 8-fluoro-4-propan-2-ylquinolin-3-amine is CC(C)c1c(N)cnc2c(F)cccc12.
What is the InChIKey of 8-fluoro-4-propan-2-ylquinolin-3-amine?
The InChIKey is OIFGLVAERUJLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2/c1-7(2)11-8-4-3-5-9(13)12(8)15-6-10(11)14/h3-7H,14H2,1-2H3.
What are the key properties of 8-fluoro-4-propan-2-ylquinolin-3-amine?
8-fluoro-4-propan-2-ylquinolin-3-amine has a molecular weight of 204.25 g/mol, XLogP of 3.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-4-propan-2-ylquinolin-3-amine is sourced from PubChem (CID 105456210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).