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

C17H25N3O2 — CID 122278733

IUPACN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide
SMILESCC(C(=O)N(C)C1CCCCC1)n1nc(C2CC2)ccc1=O
InChIInChI=1S/C17H25N3O2/c1-12(17(22)19(2)14-6-4-3-5-7-14)20-16(21)11-10-15(18-20)13-8-9-13/h10-14H,3-9H2,1-2H3
InChIKeyFSAVIHJREQCMSZ-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.47
Rot. Bonds4

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

N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide (PubChem CID 122278733) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide
PubChem CID122278733
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide
SMILESCC(C(=O)N(C)C1CCCCC1)n1nc(C2CC2)ccc1=O
InChIInChI=1S/C17H25N3O2/c1-12(17(22)19(2)14-6-4-3-5-7-14)20-16(21)11-10-15(18-20)13-8-9-13/h10-14H,3-9H2,1-2H3
InChIKeyFSAVIHJREQCMSZ-UHFFFAOYSA-N
XLogP2.47
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide?
The IUPAC name of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide (CID 122278733) is N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide.
What is the SMILES notation for N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide?
The canonical SMILES for N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide is CC(C(=O)N(C)C1CCCCC1)n1nc(C2CC2)ccc1=O.
What is the InChIKey of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide?
The InChIKey is FSAVIHJREQCMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-12(17(22)19(2)14-6-4-3-5-7-14)20-16(21)11-10-15(18-20)13-8-9-13/h10-14H,3-9H2,1-2H3.
What are the key properties of N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide?
N-cyclohexyl-2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-methylpropanamide has a molecular weight of 303.41 g/mol, XLogP of 2.47, 4 rotatable bonds, 0 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)-N-methylpropanamide is sourced from PubChem (CID 122278733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).