N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine

C15H27N3O2 — CID 80629569

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1cnc(N(CCOC)C(C)COC)c(C)c1
InChIInChI=1S/C15H27N3O2/c1-12-8-14(9-16-3)10-17-15(12)18(6-7-19-4)13(2)11-20-5/h8,10,13,16H,6-7,9,11H2,1-5H3
InChIKeyZQODDYFLCCTCFO-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.60
Rot. Bonds9

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine (PubChem CID 80629569) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine
PubChem CID80629569
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1cnc(N(CCOC)C(C)COC)c(C)c1
InChIInChI=1S/C15H27N3O2/c1-12-8-14(9-16-3)10-17-15(12)18(6-7-19-4)13(2)11-20-5/h8,10,13,16H,6-7,9,11H2,1-5H3
InChIKeyZQODDYFLCCTCFO-UHFFFAOYSA-N
XLogP1.60
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine (CID 80629569) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine is CNCc1cnc(N(CCOC)C(C)COC)c(C)c1.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine?
The InChIKey is ZQODDYFLCCTCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-12-8-14(9-16-3)10-17-15(12)18(6-7-19-4)13(2)11-20-5/h8,10,13,16H,6-7,9,11H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine has a molecular weight of 281.40 g/mol, XLogP of 1.60, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 80629569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).