N-ethyl-5-(4-methylphenoxy)pyridin-3-amine

C14H16N2O — CID 104536266

IUPACN-ethyl-5-(4-methylphenoxy)pyridin-3-amine
SMILESCCNc1cncc(Oc2ccc(C)cc2)c1
InChIInChI=1S/C14H16N2O/c1-3-16-12-8-14(10-15-9-12)17-13-6-4-11(2)5-7-13/h4-10,16H,3H2,1-2H3
InChIKeyYTMOSJAUWSDECJ-UHFFFAOYSA-N
MW228.30 g/mol
LogP3.61
Rot. Bonds4

About N-ethyl-5-(4-methylphenoxy)pyridin-3-amine

N-ethyl-5-(4-methylphenoxy)pyridin-3-amine (PubChem CID 104536266) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is N-ethyl-5-(4-methylphenoxy)pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-5-(4-methylphenoxy)pyridin-3-amine
PubChem CID104536266
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC NameN-ethyl-5-(4-methylphenoxy)pyridin-3-amine
SMILESCCNc1cncc(Oc2ccc(C)cc2)c1
InChIInChI=1S/C14H16N2O/c1-3-16-12-8-14(10-15-9-12)17-13-6-4-11(2)5-7-13/h4-10,16H,3H2,1-2H3
InChIKeyYTMOSJAUWSDECJ-UHFFFAOYSA-N
XLogP3.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(4-methylphenoxy)pyridin-3-amine?
The IUPAC name of N-ethyl-5-(4-methylphenoxy)pyridin-3-amine (CID 104536266) is N-ethyl-5-(4-methylphenoxy)pyridin-3-amine.
What is the SMILES notation for N-ethyl-5-(4-methylphenoxy)pyridin-3-amine?
The canonical SMILES for N-ethyl-5-(4-methylphenoxy)pyridin-3-amine is CCNc1cncc(Oc2ccc(C)cc2)c1.
What is the InChIKey of N-ethyl-5-(4-methylphenoxy)pyridin-3-amine?
The InChIKey is YTMOSJAUWSDECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-3-16-12-8-14(10-15-9-12)17-13-6-4-11(2)5-7-13/h4-10,16H,3H2,1-2H3.
What are the key properties of N-ethyl-5-(4-methylphenoxy)pyridin-3-amine?
N-ethyl-5-(4-methylphenoxy)pyridin-3-amine has a molecular weight of 228.30 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-methylphenoxy)pyridin-3-amine is sourced from PubChem (CID 104536266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).