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

C12H21N3O — CID 106660479

IUPACN'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine
SMILESCCN(C)CCNc1cc(C)ncc1OC
InChIInChI=1S/C12H21N3O/c1-5-15(3)7-6-13-11-8-10(2)14-9-12(11)16-4/h8-9H,5-7H2,1-4H3,(H,13,14)
InChIKeyOEFVTRIOYYAUEJ-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.76
Rot. Bonds6

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

N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine (PubChem CID 106660479) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine
PubChem CID106660479
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine
SMILESCCN(C)CCNc1cc(C)ncc1OC
InChIInChI=1S/C12H21N3O/c1-5-15(3)7-6-13-11-8-10(2)14-9-12(11)16-4/h8-9H,5-7H2,1-4H3,(H,13,14)
InChIKeyOEFVTRIOYYAUEJ-UHFFFAOYSA-N
XLogP1.76
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 106660217
ethyl 3-[(5-methoxy-2-methyl-4-pyridinyl)amino]propanoate
CID 106660444
3-[(5-methoxy-2-methyl-4-pyridinyl)amino]propanamide
CID 106660291
5-methoxy-2-methyl-N-prop-2-ynylpyridin-4-amine
CID 106660453
N'-ethyl-N-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
CID 143024311
5-methoxy-2-methyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridin-4-amine
CID 106660544
N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine
CID 106660313
5-methoxy-2-methyl-N-[2-(3-methylphenyl)ethyl]pyridin-4-amine
CID 106660460
N-benzyl-5-methoxy-2-methylpyridin-4-amine
CID 106660226
N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine
CID 106660273
1-N-[2-[ethyl(methyl)amino]ethyl]-2-fluoro-5-methoxybenzene-1,4-diamine
CID 107259174
N-(5-methoxy-2-methyl-4-pyridinyl)-N',2-dimethylpropane-1,3-diamine
CID 106660920

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine (CID 106660479) is N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine is CCN(C)CCNc1cc(C)ncc1OC.
What is the InChIKey of N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine?
The InChIKey is OEFVTRIOYYAUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-5-15(3)7-6-13-11-8-10(2)14-9-12(11)16-4/h8-9H,5-7H2,1-4H3,(H,13,14).
What are the key properties of N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine?
N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine has a molecular weight of 223.32 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-(5-methoxy-2-methyl-4-pyridinyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 106660479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).