N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

C17H22N2O2 — CID 61374245

IUPACN-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCOc1ccc(C(C)Nc2cccnc2OC(C)C)cc1
InChIInChI=1S/C17H22N2O2/c1-12(2)21-17-16(6-5-11-18-17)19-13(3)14-7-9-15(20-4)10-8-14/h5-13,19H,1-4H3
InChIKeyZJMGUBBDEWJIGL-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.05
Rot. Bonds6

About N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (PubChem CID 61374245) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
PubChem CID61374245
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCOc1ccc(C(C)Nc2cccnc2OC(C)C)cc1
InChIInChI=1S/C17H22N2O2/c1-12(2)21-17-16(6-5-11-18-17)19-13(3)14-7-9-15(20-4)10-8-14/h5-13,19H,1-4H3
InChIKeyZJMGUBBDEWJIGL-UHFFFAOYSA-N
XLogP4.05
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(4-methoxyphenyl)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-(4-methoxyphenyl)ethyl]-2-methylpyridin-3-amine
CID 79041915
N-[1-(4-methoxyphenyl)ethyl]quinolin-8-amine
CID 43191660
2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine
CID 43721905
N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374230
N-[1-(5-methylfuran-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61375389
N-[1-(4-methoxyphenyl)ethyl]-2-nitropyridin-3-amine
CID 115597004
N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61375750
N-butan-2-yl-2-propan-2-yloxypyridin-3-amine
CID 61374234
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 84580740
N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 43706283
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine
CID 83075504
N-[cyclopropyl(phenyl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 63454223

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (CID 61374245) is N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is COc1ccc(C(C)Nc2cccnc2OC(C)C)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The InChIKey is ZJMGUBBDEWJIGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-12(2)21-17-16(6-5-11-18-17)19-13(3)14-7-9-15(20-4)10-8-14/h5-13,19H,1-4H3.
What are the key properties of N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine has a molecular weight of 286.38 g/mol, XLogP of 4.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 61374245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).