8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine

C17H23FN2 — CID 63479938

IUPAC8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine
SMILESCCCNc1c(C(C)C)c(C)nc2c(F)cc(C)cc12
InChIInChI=1S/C17H23FN2/c1-6-7-19-17-13-8-11(4)9-14(18)16(13)20-12(5)15(17)10(2)3/h8-10H,6-7H2,1-5H3,(H,19,20)
InChIKeyHSZQWTKBHGPPGB-UHFFFAOYSA-N
MW274.38 g/mol
LogP4.94
Rot. Bonds4

About 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine

8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine (PubChem CID 63479938) has the molecular formula C17H23FN2 and a molecular weight of 274.38 g/mol. Its IUPAC name is 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine
PubChem CID63479938
Molecular FormulaC17H23FN2
Molecular Weight274.38 g/mol
Exact Mass274.18
IUPAC Name8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine
SMILESCCCNc1c(C(C)C)c(C)nc2c(F)cc(C)cc12
InChIInChI=1S/C17H23FN2/c1-6-7-19-17-13-8-11(4)9-14(18)16(13)20-12(5)15(17)10(2)3/h8-10H,6-7H2,1-5H3,(H,19,20)
InChIKeyHSZQWTKBHGPPGB-UHFFFAOYSA-N
XLogP4.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.38
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-fluoro-8-iodo-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 79772075
8-fluoro-6-methyl-2-propan-2-yl-N-propylquinolin-4-amine
CID 63479615
8-chloro-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 63480623
8-fluoro-3,6-dimethyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743224
7-chloro-2,8-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 63481435
8-bromo-5-fluoro-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 107629002
4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63480102
8-(methoxymethyl)-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 63482759
8-chloro-2,5-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 107628768
5-chloro-7-fluoro-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 107370538
5,8-difluoro-2,3,6-trimethyl-N-propylquinolin-4-amine
CID 103587346
N-ethyl-7-fluoro-2,6-dimethyl-3-propan-2-ylquinolin-4-amine
CID 103996194

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine?
The IUPAC name of 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine (CID 63479938) is 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine.
What is the SMILES notation for 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine?
The canonical SMILES for 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine is CCCNc1c(C(C)C)c(C)nc2c(F)cc(C)cc12.
What is the InChIKey of 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine?
The InChIKey is HSZQWTKBHGPPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2/c1-6-7-19-17-13-8-11(4)9-14(18)16(13)20-12(5)15(17)10(2)3/h8-10H,6-7H2,1-5H3,(H,19,20).
What are the key properties of 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine?
8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine has a molecular weight of 274.38 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2,6-dimethyl-3-propan-2-yl-N-propylquinolin-4-amine is sourced from PubChem (CID 63479938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).