N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide

C13H15N5O2 — CID 133339567

IUPACN-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCOc2cccnc2)nn1
InChIInChI=1S/C13H15N5O2/c1-14-13(19)11-4-5-12(18-17-11)16-7-8-20-10-3-2-6-15-9-10/h2-6,9H,7-8H2,1H3,(H,14,19)(H,16,18)
InChIKeySGQHETDINFAVPR-UHFFFAOYSA-N
MW273.30 g/mol
LogP0.72
Rot. Bonds6

About N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide

N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide (PubChem CID 133339567) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide
PubChem CID133339567
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC NameN-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCOc2cccnc2)nn1
InChIInChI=1S/C13H15N5O2/c1-14-13(19)11-4-5-12(18-17-11)16-7-8-20-10-3-2-6-15-9-10/h2-6,9H,7-8H2,1H3,(H,14,19)(H,16,18)
InChIKeySGQHETDINFAVPR-UHFFFAOYSA-N
XLogP0.72
TPSA89.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

6-[3-(4-fluorophenoxy)propylamino]-N-methylpyridazine-3-carboxamide
CID 133329134
6-[2-(2-methoxyethoxy)ethylamino]-N-methylpyridazine-3-carboxamide
CID 79207000
6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide
CID 133313334
6-(methylamino)-N-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 62179050
6-(3-butoxypropylamino)-N-methylpyridazine-3-carboxamide
CID 115669013
6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine
CID 75509865
6-(4-hydroxybutylamino)-N-methylpyridazine-3-carboxamide
CID 106842680
6-[2-[ethyl(methyl)amino]ethylamino]-N-methylpyridazine-3-carboxamide
CID 79207290
6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide
CID 79005945
N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide
CID 79207474
tert-butyl N-[2-[[6-(methylcarbamoyl)pyridazin-3-yl]amino]ethyl]carbamate
CID 115669050
N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133343379

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide (CID 133339567) is N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide is CNC(=O)c1ccc(NCCOc2cccnc2)nn1.
What is the InChIKey of N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide?
The InChIKey is SGQHETDINFAVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-14-13(19)11-4-5-12(18-17-11)16-7-8-20-10-3-2-6-15-9-10/h2-6,9H,7-8H2,1H3,(H,14,19)(H,16,18).
What are the key properties of N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide?
N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 0.72, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 133339567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).