N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide

C15H23N3O2 — CID 102866579

IUPACN-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(CCCO)C1CCC1
InChIInChI=1S/C15H23N3O2/c1-3-14-13(10-11(2)16-17-14)15(20)18(8-5-9-19)12-6-4-7-12/h10,12,19H,3-9H2,1-2H3
InChIKeyBXPNZJBVZSSNEH-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.72
Rot. Bonds6

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

N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide (PubChem CID 102866579) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide
PubChem CID102866579
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide
SMILESCCc1nnc(C)cc1C(=O)N(CCCO)C1CCC1
InChIInChI=1S/C15H23N3O2/c1-3-14-13(10-11(2)16-17-14)15(20)18(8-5-9-19)12-6-4-7-12/h10,12,19H,3-9H2,1-2H3
InChIKeyBXPNZJBVZSSNEH-UHFFFAOYSA-N
XLogP1.72
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.72
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-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide?
The IUPAC name of N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide (CID 102866579) is N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide.
What is the SMILES notation for N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide?
The canonical SMILES for N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide is CCc1nnc(C)cc1C(=O)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide?
The InChIKey is BXPNZJBVZSSNEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-14-13(10-11(2)16-17-14)15(20)18(8-5-9-19)12-6-4-7-12/h10,12,19H,3-9H2,1-2H3.
What are the key properties of N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide?
N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.72, 6 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-(3-hydroxypropyl)-6-methylpyridazine-4-carboxamide is sourced from PubChem (CID 102866579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).