N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine

C13H22N2O — CID 105146359

IUPACN-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine
SMILESCCNC(COC(C)C)c1ccc(C)nc1
InChIInChI=1S/C13H22N2O/c1-5-14-13(9-16-10(2)3)12-7-6-11(4)15-8-12/h6-8,10,13-14H,5,9H2,1-4H3
InChIKeyXGKMGDKQMLFPMY-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.47
Rot. Bonds6

About N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine

N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine (PubChem CID 105146359) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine.

Molecular Properties

Compound NameN-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine
PubChem CID105146359
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine
SMILESCCNC(COC(C)C)c1ccc(C)nc1
InChIInChI=1S/C13H22N2O/c1-5-14-13(9-16-10(2)3)12-7-6-11(4)15-8-12/h6-8,10,13-14H,5,9H2,1-4H3
InChIKeyXGKMGDKQMLFPMY-UHFFFAOYSA-N
XLogP2.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
CID 63155925
N-ethyl-4-methyl-1-(6-methyl-3-pyridinyl)pentan-1-amine
CID 63156106
ethane;(1S)-N-ethyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 143971638
N-ethyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155732
methyl 3-(ethylamino)-3-(6-methyl-3-pyridinyl)propanoate
CID 104823947
N-ethyl-1-(6-methyl-3-pyridinyl)undecan-1-amine
CID 105138195
N-ethyl-1-(6-methyl-3-pyridinyl)octan-1-amine
CID 115855028
N-ethyl-1-(6-methyl-2-pyridinyl)-2-propan-2-yloxyethanamine
CID 79574629
1-(4-bromo-3-methylphenyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 105013094
2-cycloheptyl-N-ethyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 115854866
1-(3,4-difluorophenyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 79574237
2-(2,6-dimethylphenyl)-N-ethyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 105174614

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine?
The IUPAC name of N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine (CID 105146359) is N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine.
What is the SMILES notation for N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine?
The canonical SMILES for N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine is CCNC(COC(C)C)c1ccc(C)nc1.
What is the InChIKey of N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine?
The InChIKey is XGKMGDKQMLFPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-5-14-13(9-16-10(2)3)12-7-6-11(4)15-8-12/h6-8,10,13-14H,5,9H2,1-4H3.
What are the key properties of N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine?
N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine has a molecular weight of 222.33 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(6-methyl-3-pyridinyl)-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105146359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).