N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide

C15H22N4O2 — CID 52901697

IUPACN-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCC1CCN(c2ccc(=O)n(CC(=O)NC3CC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-11-6-8-18(9-7-11)13-4-5-15(21)19(17-13)10-14(20)16-12-2-3-12/h4-5,11-12H,2-3,6-10H2,1H3,(H,16,20)
InChIKeyZGJBVOJKPPXCFC-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.76
Rot. Bonds4

About N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide

N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide (PubChem CID 52901697) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
PubChem CID52901697
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCC1CCN(c2ccc(=O)n(CC(=O)NC3CC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-11-6-8-18(9-7-11)13-4-5-15(21)19(17-13)10-14(20)16-12-2-3-12/h4-5,11-12H,2-3,6-10H2,1H3,(H,16,20)
InChIKeyZGJBVOJKPPXCFC-UHFFFAOYSA-N
XLogP0.76
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide (CID 52901697) is N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide is CC1CCN(c2ccc(=O)n(CC(=O)NC3CC3)n2)CC1.
What is the InChIKey of N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The InChIKey is ZGJBVOJKPPXCFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11-6-8-18(9-7-11)13-4-5-15(21)19(17-13)10-14(20)16-12-2-3-12/h4-5,11-12H,2-3,6-10H2,1H3,(H,16,20).
What are the key properties of N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide has a molecular weight of 290.37 g/mol, XLogP of 0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide is sourced from PubChem (CID 52901697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).