2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide

C13H22N4O — CID 82951585

IUPAC2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)nc1N(CCOC)C(C)C
InChIInChI=1S/C13H22N4O/c1-9(2)17(7-8-18-4)13-11(12(14)15)6-5-10(3)16-13/h5-6,9H,7-8H2,1-4H3,(H3,14,15)
InChIKeyFEOPDKMMKXOSSP-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.54
Rot. Bonds6

About 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide

2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide (PubChem CID 82951585) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide.

Molecular Properties

Compound Name2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide
PubChem CID82951585
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)nc1N(CCOC)C(C)C
InChIInChI=1S/C13H22N4O/c1-9(2)17(7-8-18-4)13-11(12(14)15)6-5-10(3)16-13/h5-6,9H,7-8H2,1-4H3,(H3,14,15)
InChIKeyFEOPDKMMKXOSSP-UHFFFAOYSA-N
XLogP1.54
TPSA75.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.54
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-[3-methoxypropyl(methyl)amino]-6-methylpyridine-3-carboximidamide
CID 62984137
2-chloro-4-[2-methoxyethyl(propan-2-yl)amino]benzenecarboximidamide
CID 82950924
2-[2-[di(propan-2-yl)amino]ethoxy]-6-methylpyridine-3-carboximidamide
CID 115505587
2-[2-hydroxyethyl(propan-2-yl)amino]-6-(trifluoromethyl)pyridine-3-carboximidamide
CID 79877260
2-[2-methoxyethyl(propan-2-yl)amino]-5-(trifluoromethyl)benzenecarboximidamide
CID 82939570
2-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-3-carboximidamide
CID 55004075
2-[3-hydroxypropyl(propan-2-yl)amino]-6-(trifluoromethyl)pyridine-3-carboximidamide
CID 79874812
N'-hydroxy-2-[2-methoxyethyl(propan-2-yl)amino]-4,6-dimethylpyridine-3-carboximidamide
CID 82951763
2-[butan-2-yl(2-methoxyethyl)amino]-4-chlorobenzenecarboximidamide
CID 55180801
2-[1-cyclopropylethyl(2-methoxyethyl)amino]benzenecarboximidamide
CID 55004124
2-[2-methoxyethyl(pentan-3-yl)amino]-5-methylbenzenecarboximidamide
CID 107930430
2-[2-methoxyethyl(pentan-3-yl)amino]-3-methylbenzenecarboximidamide
CID 107110158

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide?
The IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide (CID 82951585) is 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide.
What is the SMILES notation for 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide?
The canonical SMILES for 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(C)nc1N(CCOC)C(C)C.
What is the InChIKey of 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide?
The InChIKey is FEOPDKMMKXOSSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9(2)17(7-8-18-4)13-11(12(14)15)6-5-10(3)16-13/h5-6,9H,7-8H2,1-4H3,(H3,14,15).
What are the key properties of 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide?
2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide has a molecular weight of 250.35 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(propan-2-yl)amino]-6-methylpyridine-3-carboximidamide is sourced from PubChem (CID 82951585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).