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

C16H20N2O — CID 81251268

IUPAC[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1cc(Oc2cccc(C(C)C)c2)c(CN)cn1
InChIInChI=1S/C16H20N2O/c1-11(2)13-5-4-6-15(8-13)19-16-7-12(3)18-10-14(16)9-17/h4-8,10-11H,9,17H2,1-3H3
InChIKeyBICROKAYVGDBMX-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.76
Rot. Bonds4

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

[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine (PubChem CID 81251268) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
PubChem CID81251268
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCc1cc(Oc2cccc(C(C)C)c2)c(CN)cn1
InChIInChI=1S/C16H20N2O/c1-11(2)13-5-4-6-15(8-13)19-16-7-12(3)18-10-14(16)9-17/h4-8,10-11H,9,17H2,1-3H3
InChIKeyBICROKAYVGDBMX-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

[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81250345
[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 81255400
3-[[5-(aminomethyl)-2-methyl-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251021
[5-chloro-2-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63456890
[2-propan-2-yl-5-(3-propan-2-ylphenoxy)pyrimidin-4-yl]methanamine
CID 62296045
[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81250497
[6-methyl-4-(4-methylsulfanylphenoxy)-3-pyridinyl]methanamine
CID 81250178
[6-methyl-4-(4-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 81238941
[4-(3-bromo-4-fluorophenoxy)-6-methyl-3-pyridinyl]methanamine
CID 83235153
[3-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63943480
[4-(4-chloronaphthalen-1-yl)oxy-6-methyl-3-pyridinyl]methanamine
CID 81255368
N-[[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methyl]propan-2-amine
CID 81255097

Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine (CID 81251268) is [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine is Cc1cc(Oc2cccc(C(C)C)c2)c(CN)cn1.
What is the InChIKey of [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is BICROKAYVGDBMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11(2)13-5-4-6-15(8-13)19-16-7-12(3)18-10-14(16)9-17/h4-8,10-11H,9,17H2,1-3H3.
What are the key properties of [6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
[6-methyl-4-(3-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-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 81251268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).