N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine

C14H16N2O — CID 55058261

IUPACN-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
SMILESCNCc1ccnc(Oc2cccc(C)c2)c1
InChIInChI=1S/C14H16N2O/c1-11-4-3-5-13(8-11)17-14-9-12(10-15-2)6-7-16-14/h3-9,15H,10H2,1-2H3
InChIKeyGYUCKXYKLQKGSW-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.90
Rot. Bonds4

About N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine

N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine (PubChem CID 55058261) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
PubChem CID55058261
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC NameN-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
SMILESCNCc1ccnc(Oc2cccc(C)c2)c1
InChIInChI=1S/C14H16N2O/c1-11-4-3-5-13(8-11)17-14-9-12(10-15-2)6-7-16-14/h3-9,15H,10H2,1-2H3
InChIKeyGYUCKXYKLQKGSW-UHFFFAOYSA-N
XLogP2.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine 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

1-[2-(3-tert-butylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62324004
N-methyl-1-(2-naphthalen-2-yloxy-4-pyridinyl)methanamine
CID 62322369
1-[2-(4-chloro-3,5-dimethylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62323652
1-(2-methoxy-4-pyridinyl)-N-methylmethanamine;hydrochloride
CID 154963549
1-[5-chloro-2-(3-methylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 114928186
2-[3-(methylaminomethyl)phenoxy]pyridine-4-carboxamide
CID 106486567
N-methyl-1-[3-[(3-methylphenoxy)methyl]phenyl]methanamine
CID 55077028
1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62297929
1-[2-[(3-methoxyphenyl)methoxy]-4-pyridinyl]-N-methylmethanamine
CID 62288969
1-[2-(2-chlorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 55058551
N-methyl-1-[3-(5-methylpyrimidin-2-yl)oxyphenyl]methanamine
CID 106486575
N-[[2-(3-propan-2-ylphenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62296745

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine (CID 55058261) is N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine is CNCc1ccnc(Oc2cccc(C)c2)c1.
What is the InChIKey of N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine?
The InChIKey is GYUCKXYKLQKGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11-4-3-5-13(8-11)17-14-9-12(10-15-2)6-7-16-14/h3-9,15H,10H2,1-2H3.
What are the key properties of N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine?
N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine has a molecular weight of 228.29 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine is sourced from PubChem (CID 55058261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).