2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine

C11H18N2O — CID 79799793

IUPAC2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
SMILESCC(C)COc1ccc(CCN)nc1
InChIInChI=1S/C11H18N2O/c1-9(2)8-14-11-4-3-10(5-6-12)13-7-11/h3-4,7,9H,5-6,8,12H2,1-2H3
InChIKeyQVCGURKCLXLNPA-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.62
Rot. Bonds5

About 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine

2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine (PubChem CID 79799793) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
PubChem CID79799793
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
SMILESCC(C)COc1ccc(CCN)nc1
InChIInChI=1S/C11H18N2O/c1-9(2)8-14-11-4-3-10(5-6-12)13-7-11/h3-4,7,9H,5-6,8,12H2,1-2H3
InChIKeyQVCGURKCLXLNPA-UHFFFAOYSA-N
XLogP1.62
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79787202
2-(5-methoxy-2-pyridinyl)ethanamine;hydrochloride
CID 86280253
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79775957
2-(5-butoxy-2-pyridinyl)ethanamine
CID 79799974
2-[[6-(2-aminoethyl)-3-pyridinyl]oxy]-N-(3-methylbutyl)acetamide
CID 79799979
2-[5-(2-phenoxyethoxy)-2-pyridinyl]ethanamine
CID 79799508
2-[5-[(4-methoxyphenyl)methoxy]-2-pyridinyl]ethanamine
CID 79799613
2-[4-methyl-6-(2-methylpropoxy)quinolin-2-yl]ethanamine
CID 82575578
2-[5-[(5-ethylthiophen-2-yl)methoxy]-2-pyridinyl]ethanamine
CID 79800152
2-[5-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2-pyridinyl]ethanamine
CID 79799511
2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine
CID 107051908
2-[3-[4-(2-methylpropoxy)phenyl]triazol-4-yl]ethanamine
CID 82199937

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine?
The IUPAC name of 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine (CID 79799793) is 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine?
The canonical SMILES for 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine is CC(C)COc1ccc(CCN)nc1.
What is the InChIKey of 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine?
The InChIKey is QVCGURKCLXLNPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9(2)8-14-11-4-3-10(5-6-12)13-7-11/h3-4,7,9H,5-6,8,12H2,1-2H3.
What are the key properties of 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine?
2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine is sourced from PubChem (CID 79799793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).