1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol

C14H17FN2O2 — CID 133394041

IUPAC1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CNc1cc(C)nc2c(F)cccc12
InChIInChI=1S/C14H17FN2O2/c1-9-6-13(16-7-10(18)8-19-2)11-4-3-5-12(15)14(11)17-9/h3-6,10,18H,7-8H2,1-2H3,(H,16,17)
InChIKeyPARGKAPRJTXIMH-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.10
Rot. Bonds5

About 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol

1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol (PubChem CID 133394041) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
PubChem CID133394041
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC Name1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CNc1cc(C)nc2c(F)cccc12
InChIInChI=1S/C14H17FN2O2/c1-9-6-13(16-7-10(18)8-19-2)11-4-3-5-12(15)14(11)17-9/h3-6,10,18H,7-8H2,1-2H3,(H,16,17)
InChIKeyPARGKAPRJTXIMH-UHFFFAOYSA-N
XLogP2.10
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol with MolForge

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Related Compounds

1-[(6-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
CID 133394039
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
2-[(8-fluoro-2-methylquinolin-4-yl)amino]-1-(oxan-4-yl)ethanol
CID 133394132
6-[(8-fluoro-2-methylquinolin-4-yl)amino]hexan-1-ol
CID 133434482
3-[(8-fluoro-2-methylquinolin-4-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 122060920
8-bromo-N-(2-methoxyethyl)-2-methylquinolin-4-amine
CID 110432998
N-[(8-fluoro-2-methylquinolin-4-yl)methyl]-2-methoxyethanamine
CID 82448807
1-(2,6-difluorophenyl)-2-[(2-methyl-8-nitroquinolin-4-yl)amino]ethanol
CID 133437468
8-fluoro-2-methyl-N-(2-methyl-3-morpholin-4-ylpropyl)quinolin-4-amine
CID 133394200
1-(2-fluorophenyl)-2-[(2-methyl-8-nitroquinolin-4-yl)amino]ethanol
CID 133436618
7,8-difluoro-N-(2-methoxyethyl)-2-methylquinolin-4-amine
CID 133499890

Frequently Asked Questions

What is the IUPAC name of 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The IUPAC name of 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol (CID 133394041) is 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol.
What is the SMILES notation for 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The canonical SMILES for 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol is COCC(O)CNc1cc(C)nc2c(F)cccc12.
What is the InChIKey of 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The InChIKey is PARGKAPRJTXIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c1-9-6-13(16-7-10(18)8-19-2)11-4-3-5-12(15)14(11)17-9/h3-6,10,18H,7-8H2,1-2H3,(H,16,17).
What are the key properties of 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol has a molecular weight of 264.30 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol is sourced from PubChem (CID 133394041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).