2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine

C12H19N3 — CID 115308081

IUPAC2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine
SMILESCc1ccc(NC(C)(CN)C2CC2)nc1
InChIInChI=1S/C12H19N3/c1-9-3-6-11(14-7-9)15-12(2,8-13)10-4-5-10/h3,6-7,10H,4-5,8,13H2,1-2H3,(H,14,15)
InChIKeyRILXNRWMPMEYOH-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.93
Rot. Bonds4

About 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine

2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine (PubChem CID 115308081) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine
PubChem CID115308081
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine
SMILESCc1ccc(NC(C)(CN)C2CC2)nc1
InChIInChI=1S/C12H19N3/c1-9-3-6-11(14-7-9)15-12(2,8-13)10-4-5-10/h3,6-7,10H,4-5,8,13H2,1-2H3,(H,14,15)
InChIKeyRILXNRWMPMEYOH-UHFFFAOYSA-N
XLogP1.93
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-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-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine?
The IUPAC name of 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine (CID 115308081) is 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine.
What is the SMILES notation for 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine?
The canonical SMILES for 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine is Cc1ccc(NC(C)(CN)C2CC2)nc1.
What is the InChIKey of 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine?
The InChIKey is RILXNRWMPMEYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-3-6-11(14-7-9)15-12(2,8-13)10-4-5-10/h3,6-7,10H,4-5,8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine?
2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine has a molecular weight of 205.31 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-N-(5-methyl-2-pyridinyl)propane-1,2-diamine is sourced from PubChem (CID 115308081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).