N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide

C15H21N3O3 — CID 30699513

IUPACN-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
SMILESCOCCn1nc(C(=O)NC(C2CC2)C2CC2)ccc1=O
InChIInChI=1S/C15H21N3O3/c1-21-9-8-18-13(19)7-6-12(17-18)15(20)16-14(10-2-3-10)11-4-5-11/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,16,20)
InChIKeyLJKXNIHHXZOZIG-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.81
Rot. Bonds7

About N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide

N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide (PubChem CID 30699513) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
PubChem CID30699513
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
SMILESCOCCn1nc(C(=O)NC(C2CC2)C2CC2)ccc1=O
InChIInChI=1S/C15H21N3O3/c1-21-9-8-18-13(19)7-6-12(17-18)15(20)16-14(10-2-3-10)11-4-5-11/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,16,20)
InChIKeyLJKXNIHHXZOZIG-UHFFFAOYSA-N
XLogP0.81
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide?
The IUPAC name of N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide (CID 30699513) is N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide?
The canonical SMILES for N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide is COCCn1nc(C(=O)NC(C2CC2)C2CC2)ccc1=O.
What is the InChIKey of N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide?
The InChIKey is LJKXNIHHXZOZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-21-9-8-18-13(19)7-6-12(17-18)15(20)16-14(10-2-3-10)11-4-5-11/h6-7,10-11,14H,2-5,8-9H2,1H3,(H,16,20).
What are the key properties of N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide?
N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 30699513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).