2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide

C13H22N4O — CID 114769367

IUPAC2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(OCC(C)(C)N(C)C)c1
InChIInChI=1S/C13H22N4O/c1-9-6-10(12(14)15)7-11(16-9)18-8-13(2,3)17(4)5/h6-7H,8H2,1-5H3,(H3,14,15)
InChIKeyRUNWJWONHOHQOA-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.39
Rot. Bonds5

About 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide

2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide (PubChem CID 114769367) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide
PubChem CID114769367
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(OCC(C)(C)N(C)C)c1
InChIInChI=1S/C13H22N4O/c1-9-6-10(12(14)15)7-11(16-9)18-8-13(2,3)17(4)5/h6-7H,8H2,1-5H3,(H3,14,15)
InChIKeyRUNWJWONHOHQOA-UHFFFAOYSA-N
XLogP1.39
TPSA75.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-methyl-6-pentoxypyridine-4-carboximidamide
CID 114769287
2-methyl-6-phenylmethoxypyridine-4-carboximidamide
CID 114769208
2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-6-methylpyridine-4-carboximidamide
CID 114769147
2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carboximidamide
CID 114769321
2-(2-ethoxyphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769243
2-[ethyl(methyl)amino]-6-methylpyridine-4-carboximidamide
CID 114768868
2-(3,5-difluorophenoxy)-6-methylpyridine-4-carboximidamide
CID 114769335
2-(4-chloro-2,6-dimethylphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769235
2-(ethylamino)-6-methylpyridine-4-carboximidamide
CID 114769014
2-(4-fluoro-N-methylanilino)-6-methylpyridine-4-carboximidamide
CID 114768994
2-methyl-6-[methyl(propan-2-yl)amino]pyridine-4-carboximidamide
CID 114768847
2-(dipropylamino)-6-methylpyridine-4-carboximidamide
CID 114768837

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide?
The IUPAC name of 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide (CID 114769367) is 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide.
What is the SMILES notation for 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide?
The canonical SMILES for 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(OCC(C)(C)N(C)C)c1.
What is the InChIKey of 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide?
The InChIKey is RUNWJWONHOHQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9-6-10(12(14)15)7-11(16-9)18-8-13(2,3)17(4)5/h6-7H,8H2,1-5H3,(H3,14,15).
What are the key properties of 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide?
2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide has a molecular weight of 250.35 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide is sourced from PubChem (CID 114769367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).