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

C16H20N2O — CID 54909715

IUPAC[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(C(C)C)cc1Oc1ccc(CN)cn1
InChIInChI=1S/C16H20N2O/c1-11(2)14-6-4-12(3)15(8-14)19-16-7-5-13(9-17)10-18-16/h4-8,10-11H,9,17H2,1-3H3
InChIKeyKYEAACKWZWJCCZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.76
Rot. Bonds4

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

[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine (PubChem CID 54909715) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine
PubChem CID54909715
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(C(C)C)cc1Oc1ccc(CN)cn1
InChIInChI=1S/C16H20N2O/c1-11(2)14-6-4-12(3)15(8-14)19-16-7-5-13(9-17)10-18-16/h4-8,10-11H,9,17H2,1-3H3
InChIKeyKYEAACKWZWJCCZ-UHFFFAOYSA-N
XLogP3.76
TPSA48.14 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 ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 61255694
[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 16781989
[2-(2-methyl-5-propan-2-ylphenoxy)pyrimidin-4-yl]methanamine
CID 107542628
5-methyl-6-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
CID 62476910
2-chloro-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidine
CID 62338137
2-[4-[(2-methyl-5-propan-2-ylphenoxy)methyl]phenyl]ethanamine
CID 105350826
5-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80875224
4-fluoro-6-(2-methyl-5-propan-2-ylphenoxy)pyrimidine
CID 113305641
[4-[(2-methyl-4-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 169301996
[6-(2-ethoxyphenoxy)-3-pyridinyl]methanamine
CID 16793659
N-[[2-(2-methyl-5-propan-2-ylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 62323489
1-methyl-4-propan-2-yl-2-propoxybenzene
CID 78907679

Frequently Asked Questions

What is the IUPAC name of [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine (CID 54909715) is [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine is Cc1ccc(C(C)C)cc1Oc1ccc(CN)cn1.
What is the InChIKey of [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is KYEAACKWZWJCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11(2)14-6-4-12(3)15(8-14)19-16-7-5-13(9-17)10-18-16/h4-8,10-11H,9,17H2,1-3H3.
What are the key properties of [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 256.35 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 54909715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).