N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine

C11H19N3O — CID 106660217

IUPACN-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine
SMILESCOc1cnc(C)cc1NCCN(C)C
InChIInChI=1S/C11H19N3O/c1-9-7-10(11(15-4)8-13-9)12-5-6-14(2)3/h7-8H,5-6H2,1-4H3,(H,12,13)
InChIKeyRLYFJRIOSQSOBG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.37
Rot. Bonds5

About N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine

N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine (PubChem CID 106660217) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine
PubChem CID106660217
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine
SMILESCOc1cnc(C)cc1NCCN(C)C
InChIInChI=1S/C11H19N3O/c1-9-7-10(11(15-4)8-13-9)12-5-6-14(2)3/h7-8H,5-6H2,1-4H3,(H,12,13)
InChIKeyRLYFJRIOSQSOBG-UHFFFAOYSA-N
XLogP1.37
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine (CID 106660217) is N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine is COc1cnc(C)cc1NCCN(C)C.
What is the InChIKey of N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine?
The InChIKey is RLYFJRIOSQSOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-7-10(11(15-4)8-13-9)12-5-6-14(2)3/h7-8H,5-6H2,1-4H3,(H,12,13).
What are the key properties of N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine?
N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine has a molecular weight of 209.29 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 106660217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).