N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

C12H18N4O2 — CID 103219324

IUPACN-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCC(C)Nc1cnn(CC(=O)NC2CC2)c(=O)c1
InChIInChI=1S/C12H18N4O2/c1-8(2)14-10-5-12(18)16(13-6-10)7-11(17)15-9-3-4-9/h5-6,8-9,14H,3-4,7H2,1-2H3,(H,15,17)
InChIKeyHIAJTGAVCXWPHR-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.34
Rot. Bonds5

About N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (PubChem CID 103219324) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
PubChem CID103219324
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCC(C)Nc1cnn(CC(=O)NC2CC2)c(=O)c1
InChIInChI=1S/C12H18N4O2/c1-8(2)14-10-5-12(18)16(13-6-10)7-11(17)15-9-3-4-9/h5-6,8-9,14H,3-4,7H2,1-2H3,(H,15,17)
InChIKeyHIAJTGAVCXWPHR-UHFFFAOYSA-N
XLogP0.34
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (CID 103219324) is N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is CC(C)Nc1cnn(CC(=O)NC2CC2)c(=O)c1.
What is the InChIKey of N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The InChIKey is HIAJTGAVCXWPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-8(2)14-10-5-12(18)16(13-6-10)7-11(17)15-9-3-4-9/h5-6,8-9,14H,3-4,7H2,1-2H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide has a molecular weight of 250.30 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is sourced from PubChem (CID 103219324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).