N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine

C13H17FN2 — CID 105476077

IUPACN-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine
SMILESFc1ccc2c(c1)CC(NC1CCC1)CN2
InChIInChI=1S/C13H17FN2/c14-10-4-5-13-9(6-10)7-12(8-15-13)16-11-2-1-3-11/h4-6,11-12,15-16H,1-3,7-8H2
InChIKeyODYNMQUGQKGAQX-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.30
Rot. Bonds2

About N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine

N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine (PubChem CID 105476077) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine.

Molecular Properties

Compound NameN-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine
PubChem CID105476077
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC NameN-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine
SMILESFc1ccc2c(c1)CC(NC1CCC1)CN2
InChIInChI=1S/C13H17FN2/c14-10-4-5-13-9(6-10)7-12(8-15-13)16-11-2-1-3-11/h4-6,11-12,15-16H,1-3,7-8H2
InChIKeyODYNMQUGQKGAQX-UHFFFAOYSA-N
XLogP2.30
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine?
The IUPAC name of N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine (CID 105476077) is N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine.
What is the SMILES notation for N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine?
The canonical SMILES for N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine is Fc1ccc2c(c1)CC(NC1CCC1)CN2.
What is the InChIKey of N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine?
The InChIKey is ODYNMQUGQKGAQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c14-10-4-5-13-9(6-10)7-12(8-15-13)16-11-2-1-3-11/h4-6,11-12,15-16H,1-3,7-8H2.
What are the key properties of N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine?
N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine has a molecular weight of 220.29 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine is sourced from PubChem (CID 105476077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).