N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide

C16H23N3O2 — CID 122246432

IUPACN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide
SMILESCC(C(=O)NC1CCCCC1)n1nc(C2CC2)ccc1=O
InChIInChI=1S/C16H23N3O2/c1-11(16(21)17-13-5-3-2-4-6-13)19-15(20)10-9-14(18-19)12-7-8-12/h9-13H,2-8H2,1H3,(H,17,21)
InChIKeyBSBAKXRJZVTACN-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.13
Rot. Bonds4

About N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide

N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide (PubChem CID 122246432) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide
PubChem CID122246432
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide
SMILESCC(C(=O)NC1CCCCC1)n1nc(C2CC2)ccc1=O
InChIInChI=1S/C16H23N3O2/c1-11(16(21)17-13-5-3-2-4-6-13)19-15(20)10-9-14(18-19)12-7-8-12/h9-13H,2-8H2,1H3,(H,17,21)
InChIKeyBSBAKXRJZVTACN-UHFFFAOYSA-N
XLogP2.13
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide?
The IUPAC name of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide (CID 122246432) is N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide?
The canonical SMILES for N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide is CC(C(=O)NC1CCCCC1)n1nc(C2CC2)ccc1=O.
What is the InChIKey of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide?
The InChIKey is BSBAKXRJZVTACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11(16(21)17-13-5-3-2-4-6-13)19-15(20)10-9-14(18-19)12-7-8-12/h9-13H,2-8H2,1H3,(H,17,21).
What are the key properties of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide?
N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide has a molecular weight of 289.38 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)propanamide is sourced from PubChem (CID 122246432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).