2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine

C11H18N4 — CID 21082863

IUPAC2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine
SMILESCC1CCC(C)N1c1ncc(N)cc1N
InChIInChI=1S/C11H18N4/c1-7-3-4-8(2)15(7)11-10(13)5-9(12)6-14-11/h5-8H,3-4,12-13H2,1-2H3
InChIKeyFDCCUJSBMGQICI-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.62
Rot. Bonds1

About 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine

2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine (PubChem CID 21082863) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine.

Molecular Properties

Compound Name2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine
PubChem CID21082863
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine
SMILESCC1CCC(C)N1c1ncc(N)cc1N
InChIInChI=1S/C11H18N4/c1-7-3-4-8(2)15(7)11-10(13)5-9(12)6-14-11/h5-8H,3-4,12-13H2,1-2H3
InChIKeyFDCCUJSBMGQICI-UHFFFAOYSA-N
XLogP1.62
TPSA68.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine?
The IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine (CID 21082863) is 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine.
What is the SMILES notation for 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine?
The canonical SMILES for 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine is CC1CCC(C)N1c1ncc(N)cc1N.
What is the InChIKey of 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine?
The InChIKey is FDCCUJSBMGQICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-7-3-4-8(2)15(7)11-10(13)5-9(12)6-14-11/h5-8H,3-4,12-13H2,1-2H3.
What are the key properties of 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine?
2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrrolidin-1-yl)pyridine-3,5-diamine is sourced from PubChem (CID 21082863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).