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

C15H18N2O — CID 16781989

IUPAC[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCC(C)c1ccccc1Oc1ccc(CN)cn1
InChIInChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-8-7-12(9-16)10-17-15/h3-8,10-11H,9,16H2,1-2H3
InChIKeyVJIFLWRKUNBTRF-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.46
Rot. Bonds4

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

[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine (PubChem CID 16781989) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
PubChem CID16781989
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCC(C)c1ccccc1Oc1ccc(CN)cn1
InChIInChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-8-7-12(9-16)10-17-15/h3-8,10-11H,9,16H2,1-2H3
InChIKeyVJIFLWRKUNBTRF-UHFFFAOYSA-N
XLogP3.46
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(2-propan-2-ylphenoxy)-3-pyridinyl]ethanamine
CID 80640158
[6-(2-ethoxyphenoxy)-3-pyridinyl]methanamine
CID 16793659
6-(2-propan-2-ylphenoxy)pyridin-3-amine
CID 16641865
[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine
CID 16795671
5-chloro-2-(2-propan-2-ylphenoxy)pyridine
CID 66234112
6-(2-propan-2-ylphenoxy)pyridine-3-sulfonamide
CID 115928047
[6-(2-prop-1-enylphenoxy)-3-pyridinyl]methanamine
CID 76938461
N-[2-[[5-(aminomethyl)-2-pyridinyl]oxy]phenyl]acetamide
CID 16789726
2-(2-butan-2-ylphenoxy)-5-(chloromethyl)pyridine
CID 61268989
[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 54909715
[4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methanamine
CID 20989440
2-[6-(2-methoxyphenoxy)-3-pyridinyl]ethanamine
CID 80639711

Frequently Asked Questions

What is the IUPAC name of [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine (CID 16781989) is [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine is CC(C)c1ccccc1Oc1ccc(CN)cn1.
What is the InChIKey of [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is VJIFLWRKUNBTRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-8-7-12(9-16)10-17-15/h3-8,10-11H,9,16H2,1-2H3.
What are the key properties of [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 16781989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).