[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine

C15H18N2O — CID 16795671

IUPAC[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine
SMILESCC(C)c1ccccc1Oc1cc(CN)ccn1
InChIInChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-9-12(10-16)7-8-17-15/h3-9,11H,10,16H2,1-2H3
InChIKeyNVPJNTCAWGZABI-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.46
Rot. Bonds4

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

[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine (PubChem CID 16795671) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine
PubChem CID16795671
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine
SMILESCC(C)c1ccccc1Oc1cc(CN)ccn1
InChIInChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-9-12(10-16)7-8-17-15/h3-9,11H,10,16H2,1-2H3
InChIKeyNVPJNTCAWGZABI-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

[6-(2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 16781989
2-[2-[[4-(aminomethyl)-2-pyridinyl]oxy]phenyl]ethanol
CID 107711711
[2-(2-propan-2-ylphenoxy)pyrimidin-4-yl]methanamine
CID 107542464
[2-(1-phenylethoxy)-4-pyridinyl]methanamine
CID 18071091
2-[6-(2-propan-2-ylphenoxy)-3-pyridinyl]ethanamine
CID 80640158
6-(2-propan-2-ylphenoxy)pyridin-3-amine
CID 16641865
[3-bromo-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 102773232
2-(chloromethyl)-6-(2-propan-2-ylphenoxy)pyridine
CID 62240218
[4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methanamine
CID 20989440
[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine
CID 61289802
N-[[2-(4-bromo-2-propan-2-ylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 115402661
N-[[2-(2-methoxyphenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62323227

Frequently Asked Questions

What is the IUPAC name of [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine?
The IUPAC name of [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine (CID 16795671) is [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine is CC(C)c1ccccc1Oc1cc(CN)ccn1.
What is the InChIKey of [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine?
The InChIKey is NVPJNTCAWGZABI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11(2)13-5-3-4-6-14(13)18-15-9-12(10-16)7-8-17-15/h3-9,11H,10,16H2,1-2H3.
What are the key properties of [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine?
[2-(2-propan-2-ylphenoxy)-4-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 [2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine is sourced from PubChem (CID 16795671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).