N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine

C17H14F2N2 — CID 62634409

IUPACN-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine
SMILESCC(Nc1ccc2ncccc2c1)c1ccc(F)c(F)c1
InChIInChI=1S/C17H14F2N2/c1-11(12-4-6-15(18)16(19)10-12)21-14-5-7-17-13(9-14)3-2-8-20-17/h2-11,21H,1H3
InChIKeyGURJBOOKUDBYFR-UHFFFAOYSA-N
MW284.31 g/mol
LogP4.69
Rot. Bonds3

About N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine

N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine (PubChem CID 62634409) has the molecular formula C17H14F2N2 and a molecular weight of 284.31 g/mol. Its IUPAC name is N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine.

Molecular Properties

Compound NameN-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine
PubChem CID62634409
Molecular FormulaC17H14F2N2
Molecular Weight284.31 g/mol
Exact Mass284.11
IUPAC NameN-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine
SMILESCC(Nc1ccc2ncccc2c1)c1ccc(F)c(F)c1
InChIInChI=1S/C17H14F2N2/c1-11(12-4-6-15(18)16(19)10-12)21-14-5-7-17-13(9-14)3-2-8-20-17/h2-11,21H,1H3
InChIKeyGURJBOOKUDBYFR-UHFFFAOYSA-N
XLogP4.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-chloro-4-fluorophenyl)ethyl]quinolin-6-amine
CID 62636651
N-[1-(2,5-difluorophenyl)ethyl]quinolin-6-amine
CID 62634757
N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine
CID 55097402
N-[1-(1,3-thiazol-4-yl)ethyl]quinolin-6-amine
CID 115928696
N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine
CID 62636644
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]quinolin-6-amine
CID 63753119
N-[1-(3,4-difluorophenyl)ethyl]-4-fluoro-3-methoxyaniline
CID 114838632
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
N-[1-(3,4-difluorophenyl)ethyl]pyrimidin-5-amine
CID 107587984
methyl 2-(quinolin-6-ylamino)propanoate
CID 66172945
3-methyl-2-(quinolin-6-ylamino)butanoic acid
CID 82539325
N-hexan-2-ylquinolin-6-amine
CID 62636483

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine?
The IUPAC name of N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine (CID 62634409) is N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine.
What is the SMILES notation for N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine?
The canonical SMILES for N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine is CC(Nc1ccc2ncccc2c1)c1ccc(F)c(F)c1.
What is the InChIKey of N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine?
The InChIKey is GURJBOOKUDBYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N2/c1-11(12-4-6-15(18)16(19)10-12)21-14-5-7-17-13(9-14)3-2-8-20-17/h2-11,21H,1H3.
What are the key properties of N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine?
N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine has a molecular weight of 284.31 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine is sourced from PubChem (CID 62634409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).