3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide

C11H17N3O2 — CID 104625488

IUPAC3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(C)CCO
InChIInChI=1S/C11H17N3O2/c1-4-10-9(7-8(2)12-13-10)11(16)14(3)5-6-15/h7,15H,4-6H2,1-3H3
InChIKeyXXZVMKDIHWPRQE-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.41
Rot. Bonds4

About 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide

3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide (PubChem CID 104625488) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide
PubChem CID104625488
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(C)CCO
InChIInChI=1S/C11H17N3O2/c1-4-10-9(7-8(2)12-13-10)11(16)14(3)5-6-15/h7,15H,4-6H2,1-3H3
InChIKeyXXZVMKDIHWPRQE-UHFFFAOYSA-N
XLogP0.41
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromoethyl)-3-ethyl-N,6-dimethylpyridazine-4-carboxamide
CID 104672507
3-ethyl-N,N-bis(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide
CID 104625733
N-[(2-aminophenyl)methyl]-3-ethyl-N,6-dimethylpyridazine-4-carboxamide
CID 104669113
N-(2-chloroethyl)-3-ethyl-6-methyl-N-propan-2-ylpyridazine-4-carboxamide
CID 104672454
3-[ethyl-(3-ethyl-6-methylpyridazine-4-carbonyl)amino]propanoic acid
CID 104669492
4-[(3-ethyl-6-methylpyridazine-4-carbonyl)-methylamino]oxolane-3-carboxylic acid
CID 104669777
N-(2-aminoethyl)-3-ethyl-6-methyl-N-(2,2,2-trifluoroethyl)pyridazine-4-carboxamide
CID 107493584
2-[(3-ethyl-6-methylpyridazine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 104669556
N-(2-hydroxyethyl)-N,2-dimethyl-5-sulfanylbenzamide
CID 107023651
methyl 2-[ethyl-(3-ethyl-6-methylpyridazine-4-carbonyl)amino]acetate
CID 104624340
3-ethyl-6-methyl-N-[2-(methylamino)ethyl]pyridazine-4-carboxamide
CID 104671356
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-ethyl-6-methylpyridazine-4-carboxamide
CID 107845640

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide?
The IUPAC name of 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide (CID 104625488) is 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide.
What is the SMILES notation for 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide?
The canonical SMILES for 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide is CCc1nnc(C)cc1C(=O)N(C)CCO.
What is the InChIKey of 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide?
The InChIKey is XXZVMKDIHWPRQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-4-10-9(7-8(2)12-13-10)11(16)14(3)5-6-15/h7,15H,4-6H2,1-3H3.
What are the key properties of 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide?
3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide is sourced from PubChem (CID 104625488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).