N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine

C17H22N2O2 — CID 103932317

IUPACN-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine
SMILESCOCc1cc(C(C)Nc2cncc(C)c2)ccc1OC
InChIInChI=1S/C17H22N2O2/c1-12-7-16(10-18-9-12)19-13(2)14-5-6-17(21-4)15(8-14)11-20-3/h5-10,13,19H,11H2,1-4H3
InChIKeyBBECLRIRIXRKQU-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.72
Rot. Bonds6

About N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine

N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine (PubChem CID 103932317) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine
PubChem CID103932317
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine
SMILESCOCc1cc(C(C)Nc2cncc(C)c2)ccc1OC
InChIInChI=1S/C17H22N2O2/c1-12-7-16(10-18-9-12)19-13(2)14-5-6-17(21-4)15(8-14)11-20-3/h5-10,13,19H,11H2,1-4H3
InChIKeyBBECLRIRIXRKQU-UHFFFAOYSA-N
XLogP3.72
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 ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-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-methoxy-3-(methoxymethyl)phenyl]ethyl]aniline
CID 43514886
2-fluoro-N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]aniline
CID 43514914
4-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethylamino]butan-2-ol
CID 64910692
N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-3-methylsulfinylpropan-1-amine
CID 115721031
N-[1-[4-(dimethylamino)phenyl]ethyl]-5-methylpyridin-3-amine
CID 103932325
N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]pyrrol-1-amine
CID 79091158
1-[4-methoxy-3-(methoxymethyl)phenyl]-N-(1H-pyrazol-4-ylmethyl)ethanamine
CID 60999677
N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-2-methylsulfanylpropan-1-amine
CID 115895571
2-methoxy-N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-2-methylpropan-1-amine
CID 115728707
3-ethoxy-N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]propan-1-amine
CID 43514919
5-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethylamino]-2-methylpentan-1-ol
CID 103905531
N-[1-(3-bromo-4-methoxyphenyl)ethyl]-3,5-dimethylaniline
CID 43763980

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine?
The IUPAC name of N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine (CID 103932317) is N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine.
What is the SMILES notation for N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine?
The canonical SMILES for N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine is COCc1cc(C(C)Nc2cncc(C)c2)ccc1OC.
What is the InChIKey of N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine?
The InChIKey is BBECLRIRIXRKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-12-7-16(10-18-9-12)19-13(2)14-5-6-17(21-4)15(8-14)11-20-3/h5-10,13,19H,11H2,1-4H3.
What are the key properties of N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine?
N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine has a molecular weight of 286.38 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-5-methylpyridin-3-amine is sourced from PubChem (CID 103932317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).