N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine

C15H18N2O — CID 62123861

IUPACN-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine
SMILESCNCc1ccc(Oc2ccc(C)nc2)c(C)c1
InChIInChI=1S/C15H18N2O/c1-11-8-13(9-16-3)5-7-15(11)18-14-6-4-12(2)17-10-14/h4-8,10,16H,9H2,1-3H3
InChIKeyHHJIWSPFIHQXOB-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.21
Rot. Bonds4

About N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine

N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine (PubChem CID 62123861) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine
PubChem CID62123861
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine
SMILESCNCc1ccc(Oc2ccc(C)nc2)c(C)c1
InChIInChI=1S/C15H18N2O/c1-11-8-13(9-16-3)5-7-15(11)18-14-6-4-12(2)17-10-14/h4-8,10,16H,9H2,1-3H3
InChIKeyHHJIWSPFIHQXOB-UHFFFAOYSA-N
XLogP3.21
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine
CID 55031360
1-[4-(3,4-dichlorophenoxy)-3-methylphenyl]-N-methylmethanamine
CID 63551292
1-[4-(3,4-difluorophenoxy)-3-methylphenyl]-N-methylmethanamine
CID 55039981
N-[[3-chloro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methyl]-2-methylpropan-2-amine
CID 81152126
N-[[3-fluoro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methyl]cyclopropanamine
CID 62072927
N-methyl-1-[3-methyl-4-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63550870
[3-fluoro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanol
CID 62074951
1-[6-(2,4-dimethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058595
[3-chloro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanol
CID 66825550
1-[3-(3,4-dimethylphenoxy)-4-methylphenyl]-N-methylmethanamine
CID 105406718
1-[4-(3-chloro-4-nitrophenoxy)-3-methylphenyl]-N-methylmethanamine
CID 62124387
1-[4-(2-fluoro-3-methylphenoxy)-3-methylphenyl]-N-methylmethanamine
CID 107659646

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine?
The IUPAC name of N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine (CID 62123861) is N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine?
The canonical SMILES for N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine is CNCc1ccc(Oc2ccc(C)nc2)c(C)c1.
What is the InChIKey of N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine?
The InChIKey is HHJIWSPFIHQXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-8-13(9-16-3)5-7-15(11)18-14-6-4-12(2)17-10-14/h4-8,10,16H,9H2,1-3H3.
What are the key properties of N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine?
N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methanamine is sourced from PubChem (CID 62123861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).