N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine

C12H20N2O2 — CID 115922325

IUPACN-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine
SMILESCCOCC(C)Nc1ccc(OC)nc1C
InChIInChI=1S/C12H20N2O2/c1-5-16-8-9(2)13-11-6-7-12(15-4)14-10(11)3/h6-7,9,13H,5,8H2,1-4H3
InChIKeyCSRZTRFEWWZJQK-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.24
Rot. Bonds6

About N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine

N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine (PubChem CID 115922325) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine
PubChem CID115922325
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine
SMILESCCOCC(C)Nc1ccc(OC)nc1C
InChIInChI=1S/C12H20N2O2/c1-5-16-8-9(2)13-11-6-7-12(15-4)14-10(11)3/h6-7,9,13H,5,8H2,1-4H3
InChIKeyCSRZTRFEWWZJQK-UHFFFAOYSA-N
XLogP2.24
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine (CID 115922325) is N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine is CCOCC(C)Nc1ccc(OC)nc1C.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine?
The InChIKey is CSRZTRFEWWZJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-5-16-8-9(2)13-11-6-7-12(15-4)14-10(11)3/h6-7,9,13H,5,8H2,1-4H3.
What are the key properties of N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine?
N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine has a molecular weight of 224.30 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-6-methoxy-2-methylpyridin-3-amine is sourced from PubChem (CID 115922325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).