N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide

C14H15N3O2 — CID 104670808

IUPACN-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
SMILESCCN(C(=O)c1ccnnc1)c1cc(O)ccc1C
InChIInChI=1S/C14H15N3O2/c1-3-17(13-8-12(18)5-4-10(13)2)14(19)11-6-7-15-16-9-11/h4-9,18H,3H2,1-2H3
InChIKeyPXMOXSVXXRPZEO-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.16
Rot. Bonds3

About N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide

N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide (PubChem CID 104670808) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
PubChem CID104670808
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
SMILESCCN(C(=O)c1ccnnc1)c1cc(O)ccc1C
InChIInChI=1S/C14H15N3O2/c1-3-17(13-8-12(18)5-4-10(13)2)14(19)11-6-7-15-16-9-11/h4-9,18H,3H2,1-2H3
InChIKeyPXMOXSVXXRPZEO-UHFFFAOYSA-N
XLogP2.16
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide (CID 104670808) is N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide.
What is the SMILES notation for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The canonical SMILES for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide is CCN(C(=O)c1ccnnc1)c1cc(O)ccc1C.
What is the InChIKey of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The InChIKey is PXMOXSVXXRPZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-3-17(13-8-12(18)5-4-10(13)2)14(19)11-6-7-15-16-9-11/h4-9,18H,3H2,1-2H3.
What are the key properties of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridazine-4-carboxamide is sourced from PubChem (CID 104670808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).