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

C16H24N4O2 — CID 53203914

IUPACN-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCn1ncc(N2CCCC(C(=O)NC3CCCC3)C2)cc1=O
InChIInChI=1S/C16H24N4O2/c1-19-15(21)9-14(10-17-19)20-8-4-5-12(11-20)16(22)18-13-6-2-3-7-13/h9-10,12-13H,2-8,11H2,1H3,(H,18,22)
InChIKeyRPCFQDWNACCGKH-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.06
Rot. Bonds3

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

N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (PubChem CID 53203914) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
PubChem CID53203914
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
SMILESCn1ncc(N2CCCC(C(=O)NC3CCCC3)C2)cc1=O
InChIInChI=1S/C16H24N4O2/c1-19-15(21)9-14(10-17-19)20-8-4-5-12(11-20)16(22)18-13-6-2-3-7-13/h9-10,12-13H,2-8,11H2,1H3,(H,18,22)
InChIKeyRPCFQDWNACCGKH-UHFFFAOYSA-N
XLogP1.06
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide (CID 53203914) is N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is Cn1ncc(N2CCCC(C(=O)NC3CCCC3)C2)cc1=O.
What is the InChIKey of N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
The InChIKey is RPCFQDWNACCGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-19-15(21)9-14(10-17-19)20-8-4-5-12(11-20)16(22)18-13-6-2-3-7-13/h9-10,12-13H,2-8,11H2,1H3,(H,18,22).
What are the key properties of N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide?
N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 53203914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).