N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine

C12H20N2O — CID 79198385

IUPACN-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine
SMILESCCNC(c1cccnc1)C(C)(C)OC
InChIInChI=1S/C12H20N2O/c1-5-14-11(12(2,3)15-4)10-7-6-8-13-9-10/h6-9,11,14H,5H2,1-4H3
InChIKeyFEGUOBIBDMOJKT-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.16
Rot. Bonds5

About N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine

N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine (PubChem CID 79198385) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine
PubChem CID79198385
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC NameN-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine
SMILESCCNC(c1cccnc1)C(C)(C)OC
InChIInChI=1S/C12H20N2O/c1-5-14-11(12(2,3)15-4)10-7-6-8-13-9-10/h6-9,11,14H,5H2,1-4H3
InChIKeyFEGUOBIBDMOJKT-UHFFFAOYSA-N
XLogP2.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-ethyl-2-methyl-1-pyridin-3-ylpropan-1-amine
CID 116726790
N-ethyl-2-methyl-2-methylsulfonyl-1-pyridin-3-ylpropan-1-amine
CID 115799186
N-ethyl-3-methoxy-1-pyridin-3-ylpropan-1-amine
CID 61412717
1-(3,4-difluorophenyl)-N-ethyl-2-methoxy-2-methylpropan-1-amine
CID 79197452
2-methyl-2-phenyl-N-propyl-1-pyridin-3-ylpropan-1-amine
CID 63084520
N-[(2,6-dimethoxyphenyl)-pyridin-3-ylmethyl]ethanamine
CID 116810300
2-methoxy-2-methyl-1-(6-methyl-3-pyridinyl)-N-propylpropan-1-amine
CID 79198511
2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol
CID 66962752
N-[(1-methylpyrazol-3-yl)-pyridin-3-ylmethyl]ethanamine
CID 65200804
1-(3-chloro-4-pyridinyl)-N-ethyl-3-methoxy-3-methylbutan-2-amine
CID 79197915
3-methoxy-3-methyl-1-pyridin-3-ylbutan-2-ol
CID 104736155
N-[cyclopropyl(pyridin-3-yl)methyl]ethanamine
CID 60923514

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine?
The IUPAC name of N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine (CID 79198385) is N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine?
The canonical SMILES for N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine is CCNC(c1cccnc1)C(C)(C)OC.
What is the InChIKey of N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine?
The InChIKey is FEGUOBIBDMOJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-5-14-11(12(2,3)15-4)10-7-6-8-13-9-10/h6-9,11,14H,5H2,1-4H3.
What are the key properties of N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine?
N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine has a molecular weight of 208.31 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 79198385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).