N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine

C13H22N2O — CID 58662200

IUPACN-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCOCCN(Cc1ccc(C)cn1)C(C)C
InChIInChI=1S/C13H22N2O/c1-11(2)15(7-8-16-4)10-13-6-5-12(3)9-14-13/h5-6,9,11H,7-8,10H2,1-4H3
InChIKeyNJHLBFVFRXFLNZ-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.25
Rot. Bonds6

About N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine

N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine (PubChem CID 58662200) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine
PubChem CID58662200
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCOCCN(Cc1ccc(C)cn1)C(C)C
InChIInChI=1S/C13H22N2O/c1-11(2)15(7-8-16-4)10-13-6-5-12(3)9-14-13/h5-6,9,11H,7-8,10H2,1-4H3
InChIKeyNJHLBFVFRXFLNZ-UHFFFAOYSA-N
XLogP2.25
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine (CID 58662200) is N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine is COCCN(Cc1ccc(C)cn1)C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine?
The InChIKey is NJHLBFVFRXFLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-11(2)15(7-8-16-4)10-13-6-5-12(3)9-14-13/h5-6,9,11H,7-8,10H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine?
N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine has a molecular weight of 222.33 g/mol, XLogP of 2.25, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine is sourced from PubChem (CID 58662200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).