1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide

C19H26N4O2S — CID 53202214

IUPAC1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide
SMILESCCCn1ncc(N2CCC(C(=O)NC(C)c3cccs3)CC2)cc1=O
InChIInChI=1S/C19H26N4O2S/c1-3-8-23-18(24)12-16(13-20-23)22-9-6-15(7-10-22)19(25)21-14(2)17-5-4-11-26-17/h4-5,11-15H,3,6-10H2,1-2H3,(H,21,25)
InChIKeyRMTPTZUASRUBHQ-UHFFFAOYSA-N
MW374.51 g/mol
LogP2.81
Rot. Bonds6

About 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide

1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide (PubChem CID 53202214) has the molecular formula C19H26N4O2S and a molecular weight of 374.51 g/mol. Its IUPAC name is 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide
PubChem CID53202214
Molecular FormulaC19H26N4O2S
Molecular Weight374.51 g/mol
Exact Mass374.18
IUPAC Name1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide
SMILESCCCn1ncc(N2CCC(C(=O)NC(C)c3cccs3)CC2)cc1=O
InChIInChI=1S/C19H26N4O2S/c1-3-8-23-18(24)12-16(13-20-23)22-9-6-15(7-10-22)19(25)21-14(2)17-5-4-11-26-17/h4-5,11-15H,3,6-10H2,1-2H3,(H,21,25)
InChIKeyRMTPTZUASRUBHQ-UHFFFAOYSA-N
XLogP2.81
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide (CID 53202214) is 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide is CCCn1ncc(N2CCC(C(=O)NC(C)c3cccs3)CC2)cc1=O.
What is the InChIKey of 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide?
The InChIKey is RMTPTZUASRUBHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2S/c1-3-8-23-18(24)12-16(13-20-23)22-9-6-15(7-10-22)19(25)21-14(2)17-5-4-11-26-17/h4-5,11-15H,3,6-10H2,1-2H3,(H,21,25).
What are the key properties of 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide?
1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide has a molecular weight of 374.51 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-oxo-1-propylpyridazin-4-yl)-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 53202214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).