N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine

C17H22N2O — CID 104536364

IUPACN-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine
SMILESCCNc1cncc(Oc2cc(C)ccc2C(C)C)c1
InChIInChI=1S/C17H22N2O/c1-5-19-14-9-15(11-18-10-14)20-17-8-13(4)6-7-16(17)12(2)3/h6-12,19H,5H2,1-4H3
InChIKeyHVXMXWIUMUHTRN-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.74
Rot. Bonds5

About N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine

N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine (PubChem CID 104536364) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine
PubChem CID104536364
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine
SMILESCCNc1cncc(Oc2cc(C)ccc2C(C)C)c1
InChIInChI=1S/C17H22N2O/c1-5-19-14-9-15(11-18-10-14)20-17-8-13(4)6-7-16(17)12(2)3/h6-12,19H,5H2,1-4H3
InChIKeyHVXMXWIUMUHTRN-UHFFFAOYSA-N
XLogP4.74
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-(4-methylphenoxy)pyridin-3-amine
CID 104536266
N-ethyl-5-(2-methylsulfanylphenoxy)pyridin-3-amine
CID 113424390
N-ethyl-5-(2-iodophenoxy)pyridin-3-amine
CID 104536566
5-(2-bromophenoxy)-N-ethylpyridin-3-amine
CID 104536174
5-(2,5-difluorophenoxy)-N-ethylpyridin-3-amine
CID 104536808
5-(2-methyl-5-propan-2-ylphenoxy)-N-propylpyridin-3-amine
CID 104536595
4-N-ethyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine
CID 80866048
2-(chloromethyl)-4-(5-methyl-2-propan-2-ylphenoxy)pyridine
CID 61269909
N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine
CID 80863610
(1S)-1-[5-(5-methyl-2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937752
(1R)-1-[5-(5-methyl-2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937751
5-(4-methyl-2-nitrophenoxy)-N-propylpyridin-3-amine
CID 104536675

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine?
The IUPAC name of N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine (CID 104536364) is N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine.
What is the SMILES notation for N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine?
The canonical SMILES for N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine is CCNc1cncc(Oc2cc(C)ccc2C(C)C)c1.
What is the InChIKey of N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine?
The InChIKey is HVXMXWIUMUHTRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-5-19-14-9-15(11-18-10-14)20-17-8-13(4)6-7-16(17)12(2)3/h6-12,19H,5H2,1-4H3.
What are the key properties of N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine?
N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine has a molecular weight of 270.38 g/mol, XLogP of 4.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine is sourced from PubChem (CID 104536364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).