8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine

C9H10ClFN2 — CID 131050920

IUPAC8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
SMILESNC1CCNc2c(Cl)cc(F)cc21
InChIInChI=1S/C9H10ClFN2/c10-7-4-5(11)3-6-8(12)1-2-13-9(6)7/h3-4,8,13H,1-2,12H2
InChIKeyYPNKUCQSBLCXAD-UHFFFAOYSA-N
MW200.64 g/mol
LogP2.29
Rot. Bonds

About 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine

8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine (PubChem CID 131050920) has the molecular formula C9H10ClFN2 and a molecular weight of 200.64 g/mol. Its IUPAC name is 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
PubChem CID131050920
Molecular FormulaC9H10ClFN2
Molecular Weight200.64 g/mol
Exact Mass200.05
IUPAC Name8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
SMILESNC1CCNc2c(Cl)cc(F)cc21
InChIInChI=1S/C9H10ClFN2/c10-7-4-5(11)3-6-8(12)1-2-13-9(6)7/h3-4,8,13H,1-2,12H2
InChIKeyYPNKUCQSBLCXAD-UHFFFAOYSA-N
XLogP2.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.64
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9-chloro-7-fluoro-2,3,4,5-tetrahydro-1H-1-benzazepin-5-yl)ethanamine
CID 83672660
(4S)-7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
CID 95240605
7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
CID 54594245
(8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)-(3,5-diamino-4,5,6,7-tetrahydroindazol-2-yl)methanone
CID 145408245
4,8-dichloro-6-iodo-1,2,3,4-tetrahydroquinoline
CID 130820660
(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
CID 124676937
8-bromo-5-chloro-1,2,3,4-tetrahydroquinolin-4-amine
CID 130934873
4-(azetidin-1-ylmethyl)-8-chloro-1,2,3,4-tetrahydroquinoline
CID 105498664
4,7-dichloro-8-fluoro-1,2,3,4-tetrahydroquinoline
CID 130787900
6,7-dimethyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 82275649
3-[(2-chloro-5-fluorophenyl)methyl]pyrrolidin-2-one
CID 102622038
(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol
CID 130639484

Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine?
The IUPAC name of 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine (CID 131050920) is 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine.
What is the SMILES notation for 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine?
The canonical SMILES for 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine is NC1CCNc2c(Cl)cc(F)cc21.
What is the InChIKey of 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine?
The InChIKey is YPNKUCQSBLCXAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClFN2/c10-7-4-5(11)3-6-8(12)1-2-13-9(6)7/h3-4,8,13H,1-2,12H2.
What are the key properties of 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine?
8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine has a molecular weight of 200.64 g/mol, XLogP of 2.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine is sourced from PubChem (CID 131050920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).