N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide

C14H22N4O3 — CID 52900977

IUPACN-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
SMILESCC(C)CNC(=O)Cn1nc(N2CCOCC2)ccc1=O
InChIInChI=1S/C14H22N4O3/c1-11(2)9-15-13(19)10-18-14(20)4-3-12(16-18)17-5-7-21-8-6-17/h3-4,11H,5-10H2,1-2H3,(H,15,19)
InChIKeyLRMIDNHUGVPZLE-UHFFFAOYSA-N
MW294.35 g/mol
LogP-0.15
Rot. Bonds5

About N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide

N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide (PubChem CID 52900977) has the molecular formula C14H22N4O3 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
PubChem CID52900977
Molecular FormulaC14H22N4O3
Molecular Weight294.35 g/mol
Exact Mass294.17
IUPAC NameN-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
SMILESCC(C)CNC(=O)Cn1nc(N2CCOCC2)ccc1=O
InChIInChI=1S/C14H22N4O3/c1-11(2)9-15-13(19)10-18-14(20)4-3-12(16-18)17-5-7-21-8-6-17/h3-4,11H,5-10H2,1-2H3,(H,15,19)
InChIKeyLRMIDNHUGVPZLE-UHFFFAOYSA-N
XLogP-0.15
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The IUPAC name of N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide (CID 52900977) is N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide is CC(C)CNC(=O)Cn1nc(N2CCOCC2)ccc1=O.
What is the InChIKey of N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The InChIKey is LRMIDNHUGVPZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3/c1-11(2)9-15-13(19)10-18-14(20)4-3-12(16-18)17-5-7-21-8-6-17/h3-4,11H,5-10H2,1-2H3,(H,15,19).
What are the key properties of N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide has a molecular weight of 294.35 g/mol, XLogP of -0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 52900977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).