N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide

C14H21N3O2 — CID 102685022

IUPACN-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(CCO)C1CCC1
InChIInChI=1S/C14H21N3O2/c1-3-13-12(9-10(2)15-16-13)14(19)17(7-8-18)11-5-4-6-11/h9,11,18H,3-8H2,1-2H3
InChIKeyJEIUXVIQSVJCGH-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.33
Rot. Bonds5

About N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide

N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide (PubChem CID 102685022) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide
PubChem CID102685022
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(CCO)C1CCC1
InChIInChI=1S/C14H21N3O2/c1-3-13-12(9-10(2)15-16-13)14(19)17(7-8-18)11-5-4-6-11/h9,11,18H,3-8H2,1-2H3
InChIKeyJEIUXVIQSVJCGH-UHFFFAOYSA-N
XLogP1.33
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide?
The IUPAC name of N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide (CID 102685022) is N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide.
What is the SMILES notation for N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide?
The canonical SMILES for N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide is CCc1nnc(C)cc1C(=O)N(CCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide?
The InChIKey is JEIUXVIQSVJCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-3-13-12(9-10(2)15-16-13)14(19)17(7-8-18)11-5-4-6-11/h9,11,18H,3-8H2,1-2H3.
What are the key properties of N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide?
N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-3-ethyl-N-(2-hydroxyethyl)-6-methylpyridazine-4-carboxamide is sourced from PubChem (CID 102685022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).