6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide

C14H24N4O — CID 62178131

IUPAC6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)N(CC(C)C)C(C)C)nn1
InChIInChI=1S/C14H24N4O/c1-6-15-13-8-7-12(16-17-13)14(19)18(11(4)5)9-10(2)3/h7-8,10-11H,6,9H2,1-5H3,(H,15,17)
InChIKeyDJCLDBSJOWOHLO-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.41
Rot. Bonds6

About 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide

6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide (PubChem CID 62178131) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide
PubChem CID62178131
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)N(CC(C)C)C(C)C)nn1
InChIInChI=1S/C14H24N4O/c1-6-15-13-8-7-12(16-17-13)14(19)18(11(4)5)9-10(2)3/h7-8,10-11H,6,9H2,1-5H3,(H,15,17)
InChIKeyDJCLDBSJOWOHLO-UHFFFAOYSA-N
XLogP2.41
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide (CID 62178131) is 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide is CCNc1ccc(C(=O)N(CC(C)C)C(C)C)nn1.
What is the InChIKey of 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide?
The InChIKey is DJCLDBSJOWOHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-6-15-13-8-7-12(16-17-13)14(19)18(11(4)5)9-10(2)3/h7-8,10-11H,6,9H2,1-5H3,(H,15,17).
What are the key properties of 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide?
6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridazine-3-carboxamide is sourced from PubChem (CID 62178131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).