N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride

C11H19Cl2N5O — CID 119385085

IUPACN-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCCNC(=O)c1ccc(N2CCCC2)nn1
InChIInChI=1S/C11H17N5O.2ClH/c12-5-6-13-11(17)9-3-4-10(15-14-9)16-7-1-2-8-16;;/h3-4H,1-2,5-8,12H2,(H,13,17);2*1H
InChIKeyKLMISQRECCOGNJ-UHFFFAOYSA-N
MW308.21 g/mol
LogP0.61
Rot. Bonds4

About N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride

N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride (PubChem CID 119385085) has the molecular formula C11H19Cl2N5O and a molecular weight of 308.21 g/mol. Its IUPAC name is N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
PubChem CID119385085
Molecular FormulaC11H19Cl2N5O
Molecular Weight308.21 g/mol
Exact Mass307.10
IUPAC NameN-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
SMILESCl.Cl.NCCNC(=O)c1ccc(N2CCCC2)nn1
InChIInChI=1S/C11H17N5O.2ClH/c12-5-6-13-11(17)9-3-4-10(15-14-9)16-7-1-2-8-16;;/h3-4H,1-2,5-8,12H2,(H,13,17);2*1H
InChIKeyKLMISQRECCOGNJ-UHFFFAOYSA-N
XLogP0.61
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride 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

4-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]butanoic acid
CID 119352616
N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112519
N-(2-amino-2-phenylethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119529366
N-[(2S)-1-aminopropan-2-yl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 120508189
N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 141463742
N-[2-(1H-imidazol-5-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 121027842
6-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109112480
N-(2-aminophenyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119422691
N-(2-aminoethyl)-6-(azepan-1-yl)pyridine-3-carboxamide
CID 119382780
6-(azepan-1-yl)-N-[2-(3-chlorophenyl)ethyl]pyridazine-3-carboxamide
CID 109126321
N-cyclohexyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112450
6-(azepan-1-yl)-N-[2-(1H-indol-3-yl)ethyl]pyridazine-3-carboxamide
CID 109123273

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride?
The IUPAC name of N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride (CID 119385085) is N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride is Cl.Cl.NCCNC(=O)c1ccc(N2CCCC2)nn1.
What is the InChIKey of N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride?
The InChIKey is KLMISQRECCOGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O.2ClH/c12-5-6-13-11(17)9-3-4-10(15-14-9)16-7-1-2-8-16;;/h3-4H,1-2,5-8,12H2,(H,13,17);2*1H.
What are the key properties of N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride?
N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride has a molecular weight of 308.21 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119385085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).