2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide

C16H20N4 — CID 114768863

IUPAC2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(C)Cc2ccc(C)cc2)c1
InChIInChI=1S/C16H20N4/c1-11-4-6-13(7-5-11)10-20(3)15-9-14(16(17)18)8-12(2)19-15/h4-9H,10H2,1-3H3,(H3,17,18)
InChIKeyJCPUUZHILVXDJM-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.62
Rot. Bonds4

About 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide

2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide (PubChem CID 114768863) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide.

Molecular Properties

Compound Name2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide
PubChem CID114768863
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(C)Cc2ccc(C)cc2)c1
InChIInChI=1S/C16H20N4/c1-11-4-6-13(7-5-11)10-20(3)15-9-14(16(17)18)8-12(2)19-15/h4-9H,10H2,1-3H3,(H3,17,18)
InChIKeyJCPUUZHILVXDJM-UHFFFAOYSA-N
XLogP2.62
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.62
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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Related Compounds

2-methyl-6-[methyl(thiophen-3-ylmethyl)amino]pyridine-4-carboximidamide
CID 114768881
2-[ethyl(methyl)amino]-6-methylpyridine-4-carboximidamide
CID 114768868
6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-3-carboximidamide
CID 28799322
2-[cyclopropylmethyl(methyl)amino]-6-methylpyridine-4-carboximidamide
CID 114768906
2-(dipropylamino)-6-methylpyridine-4-carboximidamide
CID 114768837
2-[(4-methoxyphenyl)methyl-methylamino]-6-methylpyridine-4-carbothioamide
CID 114767323
2-methyl-6-[methyl(propan-2-yl)amino]pyridine-4-carboximidamide
CID 114768847
2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-6-methylpyridine-4-carboximidamide
CID 114769147
2-(4-fluoro-N-methylanilino)-6-methylpyridine-4-carboximidamide
CID 114768994
2-[ethyl(2,2,2-trifluoroethyl)amino]-6-methylpyridine-4-carboximidamide
CID 114768980
2-methyl-6-[propan-2-yl(propyl)amino]pyridine-4-carboximidamide
CID 114768874
4-[(4-fluorophenyl)methyl-methylamino]-2,6-dimethylpyridine-3-carboximidamide
CID 81036488

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide?
The IUPAC name of 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide (CID 114768863) is 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide.
What is the SMILES notation for 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide?
The canonical SMILES for 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(N(C)Cc2ccc(C)cc2)c1.
What is the InChIKey of 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide?
The InChIKey is JCPUUZHILVXDJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-11-4-6-13(7-5-11)10-20(3)15-9-14(16(17)18)8-12(2)19-15/h4-9H,10H2,1-3H3,(H3,17,18).
What are the key properties of 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide?
2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide has a molecular weight of 268.36 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-4-carboximidamide is sourced from PubChem (CID 114768863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).