N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

C16H18F2N2O — CID 61375750

IUPACN-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC(C)c1c(F)cccc1F
InChIInChI=1S/C16H18F2N2O/c1-10(2)21-16-14(8-5-9-19-16)20-11(3)15-12(17)6-4-7-13(15)18/h4-11,20H,1-3H3
InChIKeyYLCTVSZOOYONEF-UHFFFAOYSA-N
MW292.33 g/mol
LogP4.32
Rot. Bonds5

About N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (PubChem CID 61375750) has the molecular formula C16H18F2N2O and a molecular weight of 292.33 g/mol. Its IUPAC name is N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
PubChem CID61375750
Molecular FormulaC16H18F2N2O
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC(C)c1c(F)cccc1F
InChIInChI=1S/C16H18F2N2O/c1-10(2)21-16-14(8-5-9-19-16)20-11(3)15-12(17)6-4-7-13(15)18/h4-11,20H,1-3H3
InChIKeyYLCTVSZOOYONEF-UHFFFAOYSA-N
XLogP4.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374230
N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374245
N-[1-(5-methylfuran-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61375389
N-butan-2-yl-2-propan-2-yloxypyridin-3-amine
CID 61374234
2,3-difluoro-N-(2-propan-2-yloxy-3-pyridinyl)benzamide
CID 62661805
N-[1-(2-fluorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721902
N-ethyl-2-propan-2-yloxypyridin-3-amine
CID 61374229
N-(2-propan-2-yloxy-3-pyridinyl)formamide
CID 64991997
N-[1-(5-fluoro-2-pyridinyl)propyl]-2-propan-2-yloxypyridin-3-amine
CID 115938692
2-[(2-propan-2-yloxy-3-pyridinyl)amino]pentanoic acid
CID 83041938
2-chloro-N-[1-(2,6-difluorophenyl)ethyl]aniline
CID 43111468
N-[cyclopropyl(phenyl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 63454223

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (CID 61375750) is N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is CC(C)Oc1ncccc1NC(C)c1c(F)cccc1F.
What is the InChIKey of N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The InChIKey is YLCTVSZOOYONEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F2N2O/c1-10(2)21-16-14(8-5-9-19-16)20-11(3)15-12(17)6-4-7-13(15)18/h4-11,20H,1-3H3.
What are the key properties of N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine has a molecular weight of 292.33 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 61375750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).