N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide

C17H26N4O3 — CID 72934121

IUPACN-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide
SMILESCCC(C(=O)NC1CCCC1)n1ncc(N2CCOCC2)cc1=O
InChIInChI=1S/C17H26N4O3/c1-2-15(17(23)19-13-5-3-4-6-13)21-16(22)11-14(12-18-21)20-7-9-24-10-8-20/h11-13,15H,2-10H2,1H3,(H,19,23)
InChIKeyPESJNBLGTCCSSW-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.09
Rot. Bonds5

About N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide

N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide (PubChem CID 72934121) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide
PubChem CID72934121
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC NameN-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide
SMILESCCC(C(=O)NC1CCCC1)n1ncc(N2CCOCC2)cc1=O
InChIInChI=1S/C17H26N4O3/c1-2-15(17(23)19-13-5-3-4-6-13)21-16(22)11-14(12-18-21)20-7-9-24-10-8-20/h11-13,15H,2-10H2,1H3,(H,19,23)
InChIKeyPESJNBLGTCCSSW-UHFFFAOYSA-N
XLogP1.09
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide?
The IUPAC name of N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide (CID 72934121) is N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide.
What is the SMILES notation for N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide?
The canonical SMILES for N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide is CCC(C(=O)NC1CCCC1)n1ncc(N2CCOCC2)cc1=O.
What is the InChIKey of N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide?
The InChIKey is PESJNBLGTCCSSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-2-15(17(23)19-13-5-3-4-6-13)21-16(22)11-14(12-18-21)20-7-9-24-10-8-20/h11-13,15H,2-10H2,1H3,(H,19,23).
What are the key properties of N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide?
N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide has a molecular weight of 334.42 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-morpholin-4-yl-6-oxopyridazin-1-yl)butanamide is sourced from PubChem (CID 72934121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).