[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine

C17H22N2O — CID 81250497

IUPAC[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(C(C)C)c(Oc2cc(C)ncc2CN)c1
InChIInChI=1S/C17H22N2O/c1-11(2)15-6-5-12(3)7-17(15)20-16-8-13(4)19-10-14(16)9-18/h5-8,10-11H,9,18H2,1-4H3
InChIKeyPIXIZYXTXBTFGC-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.07
Rot. Bonds4

About [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine

[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine (PubChem CID 81250497) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
PubChem CID81250497
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(C(C)C)c(Oc2cc(C)ncc2CN)c1
InChIInChI=1S/C17H22N2O/c1-11(2)15-6-5-12(3)7-17(15)20-16-8-13(4)19-10-14(16)9-18/h5-8,10-11H,9,18H2,1-4H3
InChIKeyPIXIZYXTXBTFGC-UHFFFAOYSA-N
XLogP4.07
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[6-methyl-4-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanamine
CID 81250797
[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81251268
5-(chloromethyl)-2-methyl-4-(2-propan-2-ylphenoxy)pyridine
CID 81234196
(4-ethoxy-6-methyl-3-pyridinyl)methanamine
CID 81255491
[2-[(5-methyl-2-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 22688609
[4,6-dimethyl-2-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 61176130
[4-(2,4-difluorophenoxy)-6-methyl-3-pyridinyl]methanamine
CID 81254597
[4-(4-chloronaphthalen-1-yl)oxy-6-methyl-3-pyridinyl]methanamine
CID 81255368
6-methyl-2-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine
CID 79021239
[5-(5-methyl-2-propan-2-ylphenoxy)-1,3,4-thiadiazol-2-yl]methanamine
CID 80624683
[4-(2,5-dibromo-4-methoxyphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 81251048
[4-[(5-methyl-2-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 22688691

Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine (CID 81250497) is [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine is Cc1ccc(C(C)C)c(Oc2cc(C)ncc2CN)c1.
What is the InChIKey of [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is PIXIZYXTXBTFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-11(2)15-6-5-12(3)7-17(15)20-16-8-13(4)19-10-14(16)9-18/h5-8,10-11H,9,18H2,1-4H3.
What are the key properties of [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 270.38 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 81250497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).