N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide

C12H20N4O3 — CID 106158242

IUPACN-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC(CCO)COC)nn1
InChIInChI=1S/C12H20N4O3/c1-3-13-12(18)10-4-5-11(16-15-10)14-9(6-7-17)8-19-2/h4-5,9,17H,3,6-8H2,1-2H3,(H,13,18)(H,14,16)
InChIKeyDBDFXBQSUUMJOS-UHFFFAOYSA-N
MW268.32 g/mol
LogP0.04
Rot. Bonds8

About N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide

N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide (PubChem CID 106158242) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
PubChem CID106158242
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC NameN-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC(CCO)COC)nn1
InChIInChI=1S/C12H20N4O3/c1-3-13-12(18)10-4-5-11(16-15-10)14-9(6-7-17)8-19-2/h4-5,9,17H,3,6-8H2,1-2H3,(H,13,18)(H,14,16)
InChIKeyDBDFXBQSUUMJOS-UHFFFAOYSA-N
XLogP0.04
TPSA96.37 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-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

6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
CID 106154481
6-[(1-amino-4-methylpentan-3-yl)amino]-N-ethylpyridazine-3-carboxamide
CID 106357629
N-ethyl-6-(pent-1-yn-3-ylamino)pyridazine-3-carboxamide
CID 103578139
N-ethyl-6-(4-ethylsulfanylbutan-2-ylamino)pyridazine-3-carboxamide
CID 115744775
N-ethyl-6-methoxypyridazine-3-carboxamide
CID 90509402
6-[[(2R)-1-hydroxybutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
CID 133434733
4-methoxy-3-[(6-methyl-2-pyridinyl)amino]butan-1-ol
CID 106157813
6-[(1-methoxy-3-methylbutan-2-yl)amino]-N-methylpyridazine-3-carboxamide
CID 79214306
N-(3-methoxy-2-methylpropyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62174819
N-(2-methoxyethyl)-6-(1-phenylethylamino)pyridazine-3-carboxamide
CID 109113913
2-ethyl-2-[[[6-(ethylcarbamoyl)pyridazin-3-yl]amino]methyl]butanoic acid
CID 115430062
6-(ethylamino)-N-(2-propan-2-yloxyethyl)pyridazine-3-carboxamide
CID 113450833

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The IUPAC name of N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide (CID 106158242) is N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The canonical SMILES for N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide is CCNC(=O)c1ccc(NC(CCO)COC)nn1.
What is the InChIKey of N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The InChIKey is DBDFXBQSUUMJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-3-13-12(18)10-4-5-11(16-15-10)14-9(6-7-17)8-19-2/h4-5,9,17H,3,6-8H2,1-2H3,(H,13,18)(H,14,16).
What are the key properties of N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 0.04, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 106158242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).