5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine

C16H20N2O — CID 62193904

IUPAC5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(COc2ccc(C)cc2)cn1
InChIInChI=1S/C16H20N2O/c1-3-10-17-16-9-6-14(11-18-16)12-19-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,17,18)
InChIKeyDUFSQVMDOIKKMJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.79
Rot. Bonds6

About 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine

5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine (PubChem CID 62193904) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine
PubChem CID62193904
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(COc2ccc(C)cc2)cn1
InChIInChI=1S/C16H20N2O/c1-3-10-17-16-9-6-14(11-18-16)12-19-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,17,18)
InChIKeyDUFSQVMDOIKKMJ-UHFFFAOYSA-N
XLogP3.79
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-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

5-[(4-ethylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62194753
N-ethyl-5-[(4-propylphenoxy)methyl]pyridin-2-amine
CID 62548057
N-ethyl-5-[(4-ethylphenoxy)methyl]pyridin-2-amine
CID 55044783
5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 62183942
[4-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 55044751
5-[(2,6-dibromophenoxy)methyl]-N-propylpyridin-2-amine
CID 63484948
5-methoxy-N-propylpyridin-2-amine
CID 106503925
N-[[4-[(4-methylphenoxy)methyl]phenyl]methyl]propan-1-amine
CID 62450171
5-(3-methoxypropoxymethyl)-N-propylpyridin-2-amine
CID 62193134
1-methyl-4-[[4-[(4-methylphenoxy)methyl]phenoxy]methyl]benzene
CID 59641480
[5-[(4-methylphenyl)methoxy]-2-pyridinyl]hydrazine
CID 135394683
N-[1-[4-[(4-methylphenyl)methoxy]phenyl]ethyl]propan-1-amine
CID 43279374

Frequently Asked Questions

What is the IUPAC name of 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine (CID 62193904) is 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine is CCCNc1ccc(COc2ccc(C)cc2)cn1.
What is the InChIKey of 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine?
The InChIKey is DUFSQVMDOIKKMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-10-17-16-9-6-14(11-18-16)12-19-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,17,18).
What are the key properties of 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine?
5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62193904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).