N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine

C9H13FN4 — CID 176652807

IUPACN-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine
SMILESFC1CNC(CNc2cccnn2)C1
InChIInChI=1S/C9H13FN4/c10-7-4-8(11-5-7)6-12-9-2-1-3-13-14-9/h1-3,7-8,11H,4-6H2,(H,12,14)
InChIKeyDPMMZHNNSCRKNU-UHFFFAOYSA-N
MW196.23 g/mol
LogP0.59
Rot. Bonds3

About N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine

N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine (PubChem CID 176652807) has the molecular formula C9H13FN4 and a molecular weight of 196.23 g/mol. Its IUPAC name is N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine
PubChem CID176652807
Molecular FormulaC9H13FN4
Molecular Weight196.23 g/mol
Exact Mass196.11
IUPAC NameN-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine
SMILESFC1CNC(CNc2cccnn2)C1
InChIInChI=1S/C9H13FN4/c10-7-4-8(11-5-7)6-12-9-2-1-3-13-14-9/h1-3,7-8,11H,4-6H2,(H,12,14)
InChIKeyDPMMZHNNSCRKNU-UHFFFAOYSA-N
XLogP0.59
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine 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 N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine?
The IUPAC name of N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine (CID 176652807) is N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine.
What is the SMILES notation for N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine?
The canonical SMILES for N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine is FC1CNC(CNc2cccnn2)C1.
What is the InChIKey of N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine?
The InChIKey is DPMMZHNNSCRKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN4/c10-7-4-8(11-5-7)6-12-9-2-1-3-13-14-9/h1-3,7-8,11H,4-6H2,(H,12,14).
What are the key properties of N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine?
N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine has a molecular weight of 196.23 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluoropyrrolidin-2-yl)methyl]pyridazin-3-amine is sourced from PubChem (CID 176652807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).