N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide

C18H28N4O2 — CID 53202166

IUPACN-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide
SMILESCCCn1ncc(N2CCC(C(=O)NC3CCCC3)CC2)cc1=O
InChIInChI=1S/C18H28N4O2/c1-2-9-22-17(23)12-16(13-19-22)21-10-7-14(8-11-21)18(24)20-15-5-3-4-6-15/h12-15H,2-11H2,1H3,(H,20,24)
InChIKeyVKWMGSKENCVRBK-UHFFFAOYSA-N
MW332.45 g/mol
LogP1.93
Rot. Bonds5

About N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide

N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide (PubChem CID 53202166) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide
PubChem CID53202166
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC NameN-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide
SMILESCCCn1ncc(N2CCC(C(=O)NC3CCCC3)CC2)cc1=O
InChIInChI=1S/C18H28N4O2/c1-2-9-22-17(23)12-16(13-19-22)21-10-7-14(8-11-21)18(24)20-15-5-3-4-6-15/h12-15H,2-11H2,1H3,(H,20,24)
InChIKeyVKWMGSKENCVRBK-UHFFFAOYSA-N
XLogP1.93
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-[2-({[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinyl]methyl}amino)-2-oxoethyl]propanamide
CID 70755053
2-methyl-N-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinyl]methyl}-3-(1-pyrrolidinyl)propanamide
CID 70759750
1-isopropyl-N-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinyl]methyl}-L-prolinamide
CID 70780050
"3-cyclopentyl-N-[1-(6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidyl]propanamide"
CID 91911745
2-[1-(1-Ethyl-6-oxo-1,6-dihydropyridazin-4-YL)piperidin-3-YL]-N-(pentan-3-YL)acetamide
CID 91907045
N-Cyclopropyl-2-{1-[1-(cyclopropylmethyl)-6-oxo-16-dihydropyridazin-4-YL]piperidin-3-YL}acetamide
CID 91917542
1-(1-methyl-6-oxopyridazin-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-3-carboxamide
CID 53203878
N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
CID 91924008
N-(3-methylbutyl)-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 53202012
1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide
CID 53202016
4-[4-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1H-pyridazin-6-one
CID 53202026
N-cyclopentyl-1-(6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinecarboxamide
CID 53202029

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide (CID 53202166) is N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide is CCCn1ncc(N2CCC(C(=O)NC3CCCC3)CC2)cc1=O.
What is the InChIKey of N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide?
The InChIKey is VKWMGSKENCVRBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-2-9-22-17(23)12-16(13-19-22)21-10-7-14(8-11-21)18(24)20-15-5-3-4-6-15/h12-15H,2-11H2,1H3,(H,20,24).
What are the key properties of N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide?
N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide has a molecular weight of 332.45 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(6-oxo-1-propylpyridazin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 53202166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).