1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine

C13H22ClN5 — CID 55128477

IUPAC1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1CCCN1Cc1nc(NN)ccc1Cl
InChIInChI=1S/C13H22ClN5/c1-18(2)8-10-4-3-7-19(10)9-12-11(14)5-6-13(16-12)17-15/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,17)
InChIKeyUGPHZKCCODWJSE-UHFFFAOYSA-N
MW283.81 g/mol
LogP1.55
Rot. Bonds5

About 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine

1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine (PubChem CID 55128477) has the molecular formula C13H22ClN5 and a molecular weight of 283.81 g/mol. Its IUPAC name is 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
PubChem CID55128477
Molecular FormulaC13H22ClN5
Molecular Weight283.81 g/mol
Exact Mass283.16
IUPAC Name1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1CCCN1Cc1nc(NN)ccc1Cl
InChIInChI=1S/C13H22ClN5/c1-18(2)8-10-4-3-7-19(10)9-12-11(14)5-6-13(16-12)17-15/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,17)
InChIKeyUGPHZKCCODWJSE-UHFFFAOYSA-N
XLogP1.55
TPSA57.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.81
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine 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 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine (CID 55128477) is 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine is CN(C)CC1CCCN1Cc1nc(NN)ccc1Cl.
What is the InChIKey of 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine?
The InChIKey is UGPHZKCCODWJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22ClN5/c1-18(2)8-10-4-3-7-19(10)9-12-11(14)5-6-13(16-12)17-15/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,17).
What are the key properties of 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine?
1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine has a molecular weight of 283.81 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 55128477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).