8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine

C10H13FN2 — CID 82408940

IUPAC8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine
SMILESCN1CCCc2cc(N)cc(F)c21
InChIInChI=1S/C10H13FN2/c1-13-4-2-3-7-5-8(12)6-9(11)10(7)13/h5-6H,2-4,12H2,1H3
InChIKeyASUNYZMKCNJPON-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.79
Rot. Bonds

About 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine

8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine (PubChem CID 82408940) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine.

Molecular Properties

Compound Name8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine
PubChem CID82408940
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine
SMILESCN1CCCc2cc(N)cc(F)c21
InChIInChI=1S/C10H13FN2/c1-13-4-2-3-7-5-8(12)6-9(11)10(7)13/h5-6H,2-4,12H2,1H3
InChIKeyASUNYZMKCNJPON-UHFFFAOYSA-N
XLogP1.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

7-chloro-8-ethenyl-6-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 177159993
7-chloro-1-methyl-2,3,4,5-tetrahydro-1-benzazepin-9-amine
CID 82394712
6-chloro-7-fluoro-1-methyl-3,4-dihydro-2H-quinoline-8-carboxylic acid;hydrochloride
CID 171787810
6-bromo-1-methyl-3,4-dihydro-2H-quinolin-7-amine
CID 82387671
4-(2,2-dimethylpyrrolidin-1-yl)-3,5-difluoroaniline
CID 63215764
7-bromo-1-methyl-3,4-dihydro-2H-quinolin-6-amine
CID 82387669
6-tert-butyl-8-chloro-1-methyl-3,4-dihydro-2H-quinoline
CID 58331978
3-bromo-5-fluoro-4-pyrrolidin-1-ylaniline
CID 84709742
3-bromo-5-fluoro-4-piperidin-1-ylaniline
CID 84713585
7-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 129259469
6-amino-1-benzyl-8-fluoro-3,4-dihydroquinolin-2-one
CID 170748582
3,5-difluoro-4-(3,3,4-trimethylpiperazin-1-yl)aniline
CID 55217146

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine?
The IUPAC name of 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine (CID 82408940) is 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine.
What is the SMILES notation for 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine?
The canonical SMILES for 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine is CN1CCCc2cc(N)cc(F)c21.
What is the InChIKey of 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine?
The InChIKey is ASUNYZMKCNJPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c1-13-4-2-3-7-5-8(12)6-9(11)10(7)13/h5-6H,2-4,12H2,1H3.
What are the key properties of 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine?
8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine has a molecular weight of 180.23 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-1-methyl-3,4-dihydro-2H-quinolin-6-amine is sourced from PubChem (CID 82408940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).