N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide

C14H20N4O2 — CID 53203939

IUPACN-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCn1ncc(N2CCCC(C(=O)NC3CC3)C2)cc1=O
InChIInChI=1S/C14H20N4O2/c1-17-13(19)7-12(8-15-17)18-6-2-3-10(9-18)14(20)16-11-4-5-11/h7-8,10-11H,2-6,9H2,1H3,(H,16,20)
InChIKeyDUTLRAHJYKVZBQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.28
Rot. Bonds3

About N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide

N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (PubChem CID 53203939) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
PubChem CID53203939
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCn1ncc(N2CCCC(C(=O)NC3CC3)C2)cc1=O
InChIInChI=1S/C14H20N4O2/c1-17-13(19)7-12(8-15-17)18-6-2-3-10(9-18)14(20)16-11-4-5-11/h7-8,10-11H,2-6,9H2,1H3,(H,16,20)
InChIKeyDUTLRAHJYKVZBQ-UHFFFAOYSA-N
XLogP0.28
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (CID 53203939) is N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is Cn1ncc(N2CCCC(C(=O)NC3CC3)C2)cc1=O.
What is the InChIKey of N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The InChIKey is DUTLRAHJYKVZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-17-13(19)7-12(8-15-17)18-6-2-3-10(9-18)14(20)16-11-4-5-11/h7-8,10-11H,2-6,9H2,1H3,(H,16,20).
What are the key properties of N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 53203939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).