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

C9H14N4 — CID 114769014

IUPAC2-(ethylamino)-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(NCC)c1
InChIInChI=1S/C9H14N4/c1-3-12-8-5-7(9(10)11)4-6(2)13-8/h4-5H,3H2,1-2H3,(H3,10,11)(H,12,13)
InChIKeyYYTCMZWOVZULIG-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.11
Rot. Bonds3

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

2-(ethylamino)-6-methylpyridine-4-carboximidamide (PubChem CID 114769014) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-(ethylamino)-6-methylpyridine-4-carboximidamide.

Molecular Properties

Compound Name2-(ethylamino)-6-methylpyridine-4-carboximidamide
PubChem CID114769014
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name2-(ethylamino)-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(NCC)c1
InChIInChI=1S/C9H14N4/c1-3-12-8-5-7(9(10)11)4-6(2)13-8/h4-5H,3H2,1-2H3,(H3,10,11)(H,12,13)
InChIKeyYYTCMZWOVZULIG-UHFFFAOYSA-N
XLogP1.11
TPSA74.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.11
H-Bond Donors ≤ 53
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-(ethylamino)-6-methylpyridine-4-carboximidamide?
The IUPAC name of 2-(ethylamino)-6-methylpyridine-4-carboximidamide (CID 114769014) is 2-(ethylamino)-6-methylpyridine-4-carboximidamide.
What is the SMILES notation for 2-(ethylamino)-6-methylpyridine-4-carboximidamide?
The canonical SMILES for 2-(ethylamino)-6-methylpyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(NCC)c1.
What is the InChIKey of 2-(ethylamino)-6-methylpyridine-4-carboximidamide?
The InChIKey is YYTCMZWOVZULIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-3-12-8-5-7(9(10)11)4-6(2)13-8/h4-5H,3H2,1-2H3,(H3,10,11)(H,12,13).
What are the key properties of 2-(ethylamino)-6-methylpyridine-4-carboximidamide?
2-(ethylamino)-6-methylpyridine-4-carboximidamide has a molecular weight of 178.24 g/mol, XLogP of 1.11, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-6-methylpyridine-4-carboximidamide is sourced from PubChem (CID 114769014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).