N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine

C16H20N2O — CID 55045216

IUPACN-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
SMILESCNc1ccc(COc2cc(C)cc(C)c2C)cn1
InChIInChI=1S/C16H20N2O/c1-11-7-12(2)13(3)15(8-11)19-10-14-5-6-16(17-4)18-9-14/h5-9H,10H2,1-4H3,(H,17,18)
InChIKeyFTVBFPMZBMXRKL-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.63
Rot. Bonds4

About N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine

N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine (PubChem CID 55045216) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
PubChem CID55045216
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
SMILESCNc1ccc(COc2cc(C)cc(C)c2C)cn1
InChIInChI=1S/C16H20N2O/c1-11-7-12(2)13(3)15(8-11)19-10-14-5-6-16(17-4)18-9-14/h5-9H,10H2,1-4H3,(H,17,18)
InChIKeyFTVBFPMZBMXRKL-UHFFFAOYSA-N
XLogP3.63
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 62194827
5-[(2,4-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62193335
5-[(2-chloro-4-methylphenoxy)methyl]-N-methylpyridin-2-amine
CID 55104810
5-[(2,6-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62195101
5-[(2-chlorophenoxy)methyl]-N-methylpyridin-2-amine
CID 55044923
[5-[(2-fluoro-5-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 64855843
4-[(2,3,5-trimethylphenoxy)methyl]benzoic acid
CID 7017419
N-methyl-5-(quinolin-8-yloxymethyl)pyridin-2-amine
CID 62194480
5-chloro-N-ethyl-6-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 63484955
[2-methoxy-5-[(2,3,5-trimethylphenoxy)methyl]phenyl]methanamine
CID 65338686
N-methyl-1-[2-[(2,3,5-trimethylphenoxy)methyl]phenyl]methanamine
CID 62485666
4-methyl-2-[4-[(2,3,5-trimethylphenoxy)methyl]phenyl]-1,3-thiazole-5-carboxylic acid
CID 4980614

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine (CID 55045216) is N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine is CNc1ccc(COc2cc(C)cc(C)c2C)cn1.
What is the InChIKey of N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine?
The InChIKey is FTVBFPMZBMXRKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-7-12(2)13(3)15(8-11)19-10-14-5-6-16(17-4)18-9-14/h5-9H,10H2,1-4H3,(H,17,18).
What are the key properties of N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine?
N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 55045216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).