5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine

C11H18N4 — CID 83266421

IUPAC5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine
SMILESCc1cnc(NC2CCN(C)C2)cc1N
InChIInChI=1S/C11H18N4/c1-8-6-13-11(5-10(8)12)14-9-3-4-15(2)7-9/h5-6,9H,3-4,7H2,1-2H3,(H3,12,13,14)
InChIKeyNHRTZFZAOQJTSZ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.09
Rot. Bonds2

About 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine

5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine (PubChem CID 83266421) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine.

Molecular Properties

Compound Name5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine
PubChem CID83266421
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine
SMILESCc1cnc(NC2CCN(C)C2)cc1N
InChIInChI=1S/C11H18N4/c1-8-6-13-11(5-10(8)12)14-9-3-4-15(2)7-9/h5-6,9H,3-4,7H2,1-2H3,(H3,12,13,14)
InChIKeyNHRTZFZAOQJTSZ-UHFFFAOYSA-N
XLogP1.09
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine?
The IUPAC name of 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine (CID 83266421) is 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine.
What is the SMILES notation for 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine?
The canonical SMILES for 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine is Cc1cnc(NC2CCN(C)C2)cc1N.
What is the InChIKey of 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine?
The InChIKey is NHRTZFZAOQJTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-8-6-13-11(5-10(8)12)14-9-3-4-15(2)7-9/h5-6,9H,3-4,7H2,1-2H3,(H3,12,13,14).
What are the key properties of 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine?
5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine is sourced from PubChem (CID 83266421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).