N-(2-ethylbutyl)-2-methoxypyridin-3-amine

C12H20N2O — CID 43721784

IUPACN-(2-ethylbutyl)-2-methoxypyridin-3-amine
SMILESCCC(CC)CNc1cccnc1OC
InChIInChI=1S/C12H20N2O/c1-4-10(5-2)9-14-11-7-6-8-13-12(11)15-3/h6-8,10,14H,4-5,9H2,1-3H3
InChIKeyCQXONLZZLKCQLW-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.94
Rot. Bonds6

About N-(2-ethylbutyl)-2-methoxypyridin-3-amine

N-(2-ethylbutyl)-2-methoxypyridin-3-amine (PubChem CID 43721784) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is N-(2-ethylbutyl)-2-methoxypyridin-3-amine.

Molecular Properties

Compound NameN-(2-ethylbutyl)-2-methoxypyridin-3-amine
PubChem CID43721784
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC NameN-(2-ethylbutyl)-2-methoxypyridin-3-amine
SMILESCCC(CC)CNc1cccnc1OC
InChIInChI=1S/C12H20N2O/c1-4-10(5-2)9-14-11-7-6-8-13-12(11)15-3/h6-8,10,14H,4-5,9H2,1-3H3
InChIKeyCQXONLZZLKCQLW-UHFFFAOYSA-N
XLogP2.94
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-2-methoxypyridin-3-amine?
The IUPAC name of N-(2-ethylbutyl)-2-methoxypyridin-3-amine (CID 43721784) is N-(2-ethylbutyl)-2-methoxypyridin-3-amine.
What is the SMILES notation for N-(2-ethylbutyl)-2-methoxypyridin-3-amine?
The canonical SMILES for N-(2-ethylbutyl)-2-methoxypyridin-3-amine is CCC(CC)CNc1cccnc1OC.
What is the InChIKey of N-(2-ethylbutyl)-2-methoxypyridin-3-amine?
The InChIKey is CQXONLZZLKCQLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-10(5-2)9-14-11-7-6-8-13-12(11)15-3/h6-8,10,14H,4-5,9H2,1-3H3.
What are the key properties of N-(2-ethylbutyl)-2-methoxypyridin-3-amine?
N-(2-ethylbutyl)-2-methoxypyridin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 2.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-2-methoxypyridin-3-amine is sourced from PubChem (CID 43721784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).