N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide

C20H20N4OS — CID 113028800

IUPACN-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(c3ccccc3)CC2)cn1)c1cccs1
InChIInChI=1S/C20H20N4OS/c25-20(18-7-4-14-26-18)22-19-9-8-17(15-21-19)24-12-10-23(11-13-24)16-5-2-1-3-6-16/h1-9,14-15H,10-13H2,(H,21,22,25)
InChIKeyPBBQDSBFCAVDIG-UHFFFAOYSA-N
MW364.47 g/mol
LogP3.72
Rot. Bonds4

About N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide

N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide (PubChem CID 113028800) has the molecular formula C20H20N4OS and a molecular weight of 364.47 g/mol. Its IUPAC name is N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide
PubChem CID113028800
Molecular FormulaC20H20N4OS
Molecular Weight364.47 g/mol
Exact Mass364.14
IUPAC NameN-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(c3ccccc3)CC2)cn1)c1cccs1
InChIInChI=1S/C20H20N4OS/c25-20(18-7-4-14-26-18)22-19-9-8-17(15-21-19)24-12-10-23(11-13-24)16-5-2-1-3-6-16/h1-9,14-15H,10-13H2,(H,21,22,25)
InChIKeyPBBQDSBFCAVDIG-UHFFFAOYSA-N
XLogP3.72
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-pyridinyl]thiophene-2-carboxamide
CID 113029114
N-[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]thiophene-2-carboxamide
CID 113043097
N-[6-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylpyridazin-3-yl]thiophene-2-carboxamide
CID 42111617
2-N,5-N-bis(5-piperidin-1-yl-2-pyridinyl)thiophene-2,5-dicarboxamide
CID 112827563
N-[6-[4-(4-methylpiperidin-1-yl)anilino]-3-pyridinyl]thiophene-2-carboxamide
CID 113021087
N-[5-(4-formylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 113026047
N-[5-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridinyl]benzamide
CID 113029474
2-chloro-N-(5-piperidin-1-yl-2-pyridinyl)benzamide
CID 113024603
N-[4-(4-ethylpiperazin-1-yl)phenyl]thiophene-2-carboxamide
CID 7341667
N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide
CID 110461992
N-(4-chlorophenyl)-5-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109193461
N-(5-piperidin-1-yl-2-pyridinyl)-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
CID 78901118

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide (CID 113028800) is N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide is O=C(Nc1ccc(N2CCN(c3ccccc3)CC2)cn1)c1cccs1.
What is the InChIKey of N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide?
The InChIKey is PBBQDSBFCAVDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4OS/c25-20(18-7-4-14-26-18)22-19-9-8-17(15-21-19)24-12-10-23(11-13-24)16-5-2-1-3-6-16/h1-9,14-15H,10-13H2,(H,21,22,25).
What are the key properties of N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide?
N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide has a molecular weight of 364.47 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 113028800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).