N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine

C12H20N2O — CID 115922217

IUPACN-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine
SMILESCCOCC(C)Nc1ccc(C)nc1C
InChIInChI=1S/C12H20N2O/c1-5-15-8-10(3)14-12-7-6-9(2)13-11(12)4/h6-7,10,14H,5,8H2,1-4H3
InChIKeyFZRQBBAQUSDZAF-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.54
Rot. Bonds5

About N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine

N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine (PubChem CID 115922217) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine
PubChem CID115922217
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine
SMILESCCOCC(C)Nc1ccc(C)nc1C
InChIInChI=1S/C12H20N2O/c1-5-15-8-10(3)14-12-7-6-9(2)13-11(12)4/h6-7,10,14H,5,8H2,1-4H3
InChIKeyFZRQBBAQUSDZAF-UHFFFAOYSA-N
XLogP2.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine (CID 115922217) is N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine is CCOCC(C)Nc1ccc(C)nc1C.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine?
The InChIKey is FZRQBBAQUSDZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-5-15-8-10(3)14-12-7-6-9(2)13-11(12)4/h6-7,10,14H,5,8H2,1-4H3.
What are the key properties of N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine?
N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine has a molecular weight of 208.30 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-2,6-dimethylpyridin-3-amine is sourced from PubChem (CID 115922217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).