4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide

C14H18N4S — CID 61175593

IUPAC4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)cc(C)nc1N(C)Cc1cccs1
InChIInChI=1S/C14H18N4S/c1-9-7-10(2)17-14(12(9)13(15)16)18(3)8-11-5-4-6-19-11/h4-7H,8H2,1-3H3,(H3,15,16)
InChIKeyLNEKKZLMXIHTKI-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.68
Rot. Bonds4

About 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide

4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide (PubChem CID 61175593) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide.

Molecular Properties

Compound Name4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide
PubChem CID61175593
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)cc(C)nc1N(C)Cc1cccs1
InChIInChI=1S/C14H18N4S/c1-9-7-10(2)17-14(12(9)13(15)16)18(3)8-11-5-4-6-19-11/h4-7H,8H2,1-3H3,(H3,15,16)
InChIKeyLNEKKZLMXIHTKI-UHFFFAOYSA-N
XLogP2.68
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.68
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-[(5-chlorothiophen-2-yl)methyl-methylamino]-4,6-dimethylpyridine-3-carboximidamide
CID 61442720
2-[ethyl(thiophen-2-ylmethyl)amino]-4,6-dimethylpyridine-3-carbothioamide
CID 61437514
4,6-dimethyl-2-[methyl(2-methylsulfonylethyl)amino]pyridine-3-carboximidamide
CID 79849915
4,6-dimethyl-2-[methyl(2-thiophen-2-ylethyl)amino]pyridine-3-carboxylic acid
CID 79494614
2-[2-ethoxyethyl(methyl)amino]-4,6-dimethylpyridine-3-carboximidamide
CID 81055007
2-[methyl(thiophen-2-ylmethyl)amino]quinoline-4-carboximidamide
CID 63883954
2-[cyclopropyl(thiophen-2-ylmethyl)amino]-6-methylpyridine-4-carboximidamide
CID 114768951
2-methyl-6-[methyl(thiophen-2-ylmethyl)amino]pyridine-4-carbothioamide
CID 114767240
3-fluoro-4-[methyl(thiophen-2-ylmethyl)amino]benzenecarboximidamide
CID 43658312
2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carboximidamide
CID 114769321
2-[2-hydroxyethyl(propyl)amino]-4,6-dimethylpyridine-3-carboximidamide
CID 61424883
2-[(3-fluorophenyl)methyl-methylamino]-4,6-dimethylpyridine-3-carbothioamide
CID 61175772

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide?
The IUPAC name of 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide (CID 61175593) is 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide.
What is the SMILES notation for 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide?
The canonical SMILES for 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide is [H]/N=C(\N)c1c(C)cc(C)nc1N(C)Cc1cccs1.
What is the InChIKey of 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide?
The InChIKey is LNEKKZLMXIHTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-9-7-10(2)17-14(12(9)13(15)16)18(3)8-11-5-4-6-19-11/h4-7H,8H2,1-3H3,(H3,15,16).
What are the key properties of 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide?
4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide has a molecular weight of 274.39 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[methyl(thiophen-2-ylmethyl)amino]pyridine-3-carboximidamide is sourced from PubChem (CID 61175593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).