N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide

C9H11ClN4O — CID 115626531

IUPACN-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)nn1)C1CCCN1
InChIInChI=1S/C9H11ClN4O/c10-7-3-4-8(14-13-7)12-9(15)6-2-1-5-11-6/h3-4,6,11H,1-2,5H2,(H,12,14,15)
InChIKeySHRWPRAISAGSQY-UHFFFAOYSA-N
MW226.67 g/mol
LogP0.82
Rot. Bonds2

About N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide

N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide (PubChem CID 115626531) has the molecular formula C9H11ClN4O and a molecular weight of 226.67 g/mol. Its IUPAC name is N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide
PubChem CID115626531
Molecular FormulaC9H11ClN4O
Molecular Weight226.67 g/mol
Exact Mass226.06
IUPAC NameN-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)nn1)C1CCCN1
InChIInChI=1S/C9H11ClN4O/c10-7-3-4-8(14-13-7)12-9(15)6-2-1-5-11-6/h3-4,6,11H,1-2,5H2,(H,12,14,15)
InChIKeySHRWPRAISAGSQY-UHFFFAOYSA-N
XLogP0.82
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.67
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

(2S)-N-(5-chloro-2-pyridinyl)pyrrolidine-2-carboxamide
CID 24749623
N-(6-chloro-2-pyridinyl)pyrrolidine-2-carboxamide
CID 79946508
(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide
CID 104901521
N-(6-chloropyridazin-3-yl)-3,3-dimethylpiperidine-2-carboxamide
CID 114084319
(2R)-N-(4-chlorophenyl)pyrrolidine-2-carboxamide
CID 7183288
(2R)-N-pyridin-2-ylpyrrolidine-2-carboxamide
CID 103813190
N-(1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
CID 62902343
N-pyridazin-3-ylazepane-2-carboxamide
CID 116786808
(2S)-N-(6-acetamido-2-pyridinyl)pyrrolidine-2-carboxamide
CID 102178535
N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide
CID 61254641
N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119879391
(2R)-N-[4-(carbamoylamino)phenyl]pyrrolidine-2-carboxamide
CID 103794450

Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide (CID 115626531) is N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide is O=C(Nc1ccc(Cl)nn1)C1CCCN1.
What is the InChIKey of N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is SHRWPRAISAGSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN4O/c10-7-3-4-8(14-13-7)12-9(15)6-2-1-5-11-6/h3-4,6,11H,1-2,5H2,(H,12,14,15).
What are the key properties of N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide?
N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 226.67 g/mol, XLogP of 0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 115626531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).