2-(dipropylamino)-6-methylpyridine-4-carboximidamide

C13H22N4 — CID 114768837

IUPAC2-(dipropylamino)-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(CCC)CCC)c1
InChIInChI=1S/C13H22N4/c1-4-6-17(7-5-2)12-9-11(13(14)15)8-10(3)16-12/h8-9H,4-7H2,1-3H3,(H3,14,15)
InChIKeyWZMUELFYQKZIFK-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.30
Rot. Bonds6

About 2-(dipropylamino)-6-methylpyridine-4-carboximidamide

2-(dipropylamino)-6-methylpyridine-4-carboximidamide (PubChem CID 114768837) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-(dipropylamino)-6-methylpyridine-4-carboximidamide.

Molecular Properties

Compound Name2-(dipropylamino)-6-methylpyridine-4-carboximidamide
PubChem CID114768837
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name2-(dipropylamino)-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(CCC)CCC)c1
InChIInChI=1S/C13H22N4/c1-4-6-17(7-5-2)12-9-11(13(14)15)8-10(3)16-12/h8-9H,4-7H2,1-3H3,(H3,14,15)
InChIKeyWZMUELFYQKZIFK-UHFFFAOYSA-N
XLogP2.30
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-6-methylpyridine-4-carboximidamide?
The IUPAC name of 2-(dipropylamino)-6-methylpyridine-4-carboximidamide (CID 114768837) is 2-(dipropylamino)-6-methylpyridine-4-carboximidamide.
What is the SMILES notation for 2-(dipropylamino)-6-methylpyridine-4-carboximidamide?
The canonical SMILES for 2-(dipropylamino)-6-methylpyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(N(CCC)CCC)c1.
What is the InChIKey of 2-(dipropylamino)-6-methylpyridine-4-carboximidamide?
The InChIKey is WZMUELFYQKZIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-6-17(7-5-2)12-9-11(13(14)15)8-10(3)16-12/h8-9H,4-7H2,1-3H3,(H3,14,15).
What are the key properties of 2-(dipropylamino)-6-methylpyridine-4-carboximidamide?
2-(dipropylamino)-6-methylpyridine-4-carboximidamide has a molecular weight of 234.35 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-6-methylpyridine-4-carboximidamide is sourced from PubChem (CID 114768837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).