N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine

C12H20N2O — CID 63155924

IUPACN-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
SMILESCCCOCC(NC)c1ccc(C)nc1
InChIInChI=1S/C12H20N2O/c1-4-7-15-9-12(13-3)11-6-5-10(2)14-8-11/h5-6,8,12-13H,4,7,9H2,1-3H3
InChIKeyFCFZHNXFGRZOGV-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.08
Rot. Bonds6

About N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine

N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine (PubChem CID 63155924) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine.

Molecular Properties

Compound NameN-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
PubChem CID63155924
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
SMILESCCCOCC(NC)c1ccc(C)nc1
InChIInChI=1S/C12H20N2O/c1-4-7-15-9-12(13-3)11-6-5-10(2)14-8-11/h5-6,8,12-13H,4,7,9H2,1-3H3
InChIKeyFCFZHNXFGRZOGV-UHFFFAOYSA-N
XLogP2.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
CID 63155925
N-methyl-1-(6-methyl-3-pyridinyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215250
N-methyl-1-(6-methyl-3-pyridinyl)nonan-1-amine
CID 115854494
3-(2-methoxyethoxy)-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 102928103
N-methyl-2-propoxy-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81144162
3-methoxy-N,3-dimethyl-1-(6-methyl-3-pyridinyl)butan-1-amine
CID 103027120
1-(3-fluoro-4-methoxyphenyl)-N-methyl-2-propoxyethanamine
CID 62797505
N-methyl-1-(4-propan-2-yloxyphenyl)-2-(2-propoxyethoxy)ethanamine
CID 63685624
N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine
CID 105008302
2-(3,5-dimethylphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155527
ethyl 2-(methylamino)-2-(6-methyl-3-pyridinyl)acetate
CID 104822502
4-ethoxy-1-(6-methyl-3-pyridinyl)-N-propylbutan-1-amine
CID 105146367

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine?
The IUPAC name of N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine (CID 63155924) is N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine.
What is the SMILES notation for N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine?
The canonical SMILES for N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine is CCCOCC(NC)c1ccc(C)nc1.
What is the InChIKey of N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine?
The InChIKey is FCFZHNXFGRZOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-7-15-9-12(13-3)11-6-5-10(2)14-8-11/h5-6,8,12-13H,4,7,9H2,1-3H3.
What are the key properties of N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine?
N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine has a molecular weight of 208.30 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine is sourced from PubChem (CID 63155924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).