N'-methyl-N'-pyridin-4-ylmethanediamine

C7H11N3 — CID 115225635

IUPACN'-methyl-N'-pyridin-4-ylmethanediamine
SMILESCN(CN)c1ccncc1
InChIInChI=1S/C7H11N3/c1-10(6-8)7-2-4-9-5-3-7/h2-5H,6,8H2,1H3
InChIKeyRVYRSLUVWBOWFC-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.43
Rot. Bonds2

About N'-methyl-N'-pyridin-4-ylmethanediamine

N'-methyl-N'-pyridin-4-ylmethanediamine (PubChem CID 115225635) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is N'-methyl-N'-pyridin-4-ylmethanediamine.

Molecular Properties

Compound NameN'-methyl-N'-pyridin-4-ylmethanediamine
PubChem CID115225635
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC NameN'-methyl-N'-pyridin-4-ylmethanediamine
SMILESCN(CN)c1ccncc1
InChIInChI=1S/C7H11N3/c1-10(6-8)7-2-4-9-5-3-7/h2-5H,6,8H2,1H3
InChIKeyRVYRSLUVWBOWFC-UHFFFAOYSA-N
XLogP0.43
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-(2-methylpropyl)pyridin-4-amine
CID 123668191
N-methyl-N-(2,2,2-trifluoroethyl)pyridin-4-amine
CID 115257828
N,N-dimethylpyridin-4-amine
CID 14284
1-methyl-1-pyridin-4-ylhydrazine;dihydrochloride
CID 45074909
tris(N,N-dimethylpyridin-4-amine);trihydrobromide
CID 68567794
N,N-dimethylpyridin-4-amine;terbium
CID 21052224
zinc;N,N-dimethylpyridin-4-amine;dichloride
CID 175706220
N'-hydroxy-3-[methyl(pyridin-4-yl)amino]propanimidamide
CID 43186264
4-[methyl(pyridin-4-yl)amino]butan-2-ol
CID 115745235
N-(5-chloropentyl)-N-methylpyridin-4-amine
CID 107205359
lithium;N,N-dimethylpyridin-4-amine;hydroxide
CID 174914031
N-[(3-aminophenyl)methyl]-N-methylpyridin-4-amine
CID 60877422

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-pyridin-4-ylmethanediamine?
The IUPAC name of N'-methyl-N'-pyridin-4-ylmethanediamine (CID 115225635) is N'-methyl-N'-pyridin-4-ylmethanediamine.
What is the SMILES notation for N'-methyl-N'-pyridin-4-ylmethanediamine?
The canonical SMILES for N'-methyl-N'-pyridin-4-ylmethanediamine is CN(CN)c1ccncc1.
What is the InChIKey of N'-methyl-N'-pyridin-4-ylmethanediamine?
The InChIKey is RVYRSLUVWBOWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-10(6-8)7-2-4-9-5-3-7/h2-5H,6,8H2,1H3.
What are the key properties of N'-methyl-N'-pyridin-4-ylmethanediamine?
N'-methyl-N'-pyridin-4-ylmethanediamine has a molecular weight of 137.19 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-pyridin-4-ylmethanediamine is sourced from PubChem (CID 115225635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).