8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine

C18H18FN3 — CID 133394408

IUPAC8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine
SMILESCCC(Nc1cc(C)nc2c(F)cccc12)c1ccncc1
InChIInChI=1S/C18H18FN3/c1-3-16(13-7-9-20-10-8-13)22-17-11-12(2)21-18-14(17)5-4-6-15(18)19/h4-11,16H,3H2,1-2H3,(H,21,22)
InChIKeyKFFVZTCATHCTCM-UHFFFAOYSA-N
MW295.36 g/mol
LogP4.64
Rot. Bonds4

About 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine

8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine (PubChem CID 133394408) has the molecular formula C18H18FN3 and a molecular weight of 295.36 g/mol. Its IUPAC name is 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine
PubChem CID133394408
Molecular FormulaC18H18FN3
Molecular Weight295.36 g/mol
Exact Mass295.15
IUPAC Name8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine
SMILESCCC(Nc1cc(C)nc2c(F)cccc12)c1ccncc1
InChIInChI=1S/C18H18FN3/c1-3-16(13-7-9-20-10-8-13)22-17-11-12(2)21-18-14(17)5-4-6-15(18)19/h4-11,16H,3H2,1-2H3,(H,21,22)
InChIKeyKFFVZTCATHCTCM-UHFFFAOYSA-N
XLogP4.64
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-but-3-en-2-yl-8-fluoro-2-methylquinolin-4-amine
CID 133369006
3-[[(8-fluoro-2-methylquinolin-4-yl)amino]methyl]pentan-1-ol
CID 133368901
8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine
CID 133368255
6-[(8-fluoro-2-methylquinolin-4-yl)amino]hexan-1-ol
CID 133434482
1-[(8-fluoro-2-methylquinolin-4-yl)amino]-2-thiophen-2-ylpropan-2-ol
CID 133394254
1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
CID 133394041
3-[(8-fluoro-2-methylquinolin-4-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 122060920
N-[cyclopropyl-(5-methyl-1,3-thiazol-2-yl)methyl]-8-fluoro-2-methylquinolin-4-amine
CID 133394548
3-fluoro-N-[1-(4-fluorophenyl)propyl]-2-methylaniline
CID 55194278
8-fluoro-2-methyl-N-propylquinoline-4-carboxamide
CID 110489274
2-(3-chloro-4-fluorophenyl)-2-[(8-methoxy-2-methylquinolin-4-yl)amino]ethanol
CID 166383018
4-[(8-methoxy-2-methylquinolin-4-yl)amino]-4-phenylbutan-1-ol
CID 133394349

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine?
The IUPAC name of 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine (CID 133394408) is 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine.
What is the SMILES notation for 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine?
The canonical SMILES for 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine is CCC(Nc1cc(C)nc2c(F)cccc12)c1ccncc1.
What is the InChIKey of 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine?
The InChIKey is KFFVZTCATHCTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3/c1-3-16(13-7-9-20-10-8-13)22-17-11-12(2)21-18-14(17)5-4-6-15(18)19/h4-11,16H,3H2,1-2H3,(H,21,22).
What are the key properties of 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine?
8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine has a molecular weight of 295.36 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-N-(1-pyridin-4-ylpropyl)quinolin-4-amine is sourced from PubChem (CID 133394408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).