6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide

C10H16N6O2 — CID 83114171

IUPAC6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCNC(N)=O)nn1
InChIInChI=1S/C10H16N6O2/c1-16(2)9(17)7-3-4-8(15-14-7)12-5-6-13-10(11)18/h3-4H,5-6H2,1-2H3,(H,12,15)(H3,11,13,18)
InChIKeyFVRYBQZXPOKICL-UHFFFAOYSA-N
MW252.28 g/mol
LogP-0.74
Rot. Bonds5

About 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide

6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide (PubChem CID 83114171) has the molecular formula C10H16N6O2 and a molecular weight of 252.28 g/mol. Its IUPAC name is 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide
PubChem CID83114171
Molecular FormulaC10H16N6O2
Molecular Weight252.28 g/mol
Exact Mass252.13
IUPAC Name6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCNC(N)=O)nn1
InChIInChI=1S/C10H16N6O2/c1-16(2)9(17)7-3-4-8(15-14-7)12-5-6-13-10(11)18/h3-4H,5-6H2,1-2H3,(H,12,15)(H3,11,13,18)
InChIKeyFVRYBQZXPOKICL-UHFFFAOYSA-N
XLogP-0.74
TPSA113.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-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

2-[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]ethyl carbamate
CID 83203413
6-hydrazinyl-N,N-dimethylpyridazine-3-carboxamide
CID 62236767
6-(2-acetamidoethylamino)pyridazine-3-carboxamide
CID 79769956
6-[(2-amino-4,4-dimethylpentyl)amino]-N,N-dimethylpyridazine-3-carboxamide
CID 107159223
N,N-dimethyl-6-(3-methylpentan-3-ylamino)pyridazine-3-carboxamide
CID 106329496
N,N-dimethyl-6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]pyridazine-3-carboxamide
CID 106418721
N-methyl-N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62169151
N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide
CID 114794623
N-[2-(dimethylamino)ethyl]-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115146
N,N-dimethyl-6-[(2-methylcyclopentyl)methylamino]pyridazine-3-carboxamide
CID 107419298
N,N-dimethyl-6-[(1-methylpyrazol-3-yl)methylamino]pyridazine-3-carboxamide
CID 82874048
N-(2,2-dimethylpropyl)-N-methyl-6-(propylamino)pyridazine-3-carboxamide
CID 62178802

Frequently Asked Questions

What is the IUPAC name of 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide?
The IUPAC name of 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide (CID 83114171) is 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide?
The canonical SMILES for 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide is CN(C)C(=O)c1ccc(NCCNC(N)=O)nn1.
What is the InChIKey of 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide?
The InChIKey is FVRYBQZXPOKICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O2/c1-16(2)9(17)7-3-4-8(15-14-7)12-5-6-13-10(11)18/h3-4H,5-6H2,1-2H3,(H,12,15)(H3,11,13,18).
What are the key properties of 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide?
6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide has a molecular weight of 252.28 g/mol, XLogP of -0.74, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide is sourced from PubChem (CID 83114171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).