N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide

C22H28N2O2S — CID 90595713

IUPACN-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESCOC1CCN(c2ccc(NC(=O)C3(c4cccs4)CCCC3)cc2)CC1
InChIInChI=1S/C22H28N2O2S/c1-26-19-10-14-24(15-11-19)18-8-6-17(7-9-18)23-21(25)22(12-2-3-13-22)20-5-4-16-27-20/h4-9,16,19H,2-3,10-15H2,1H3,(H,23,25)
InChIKeyNATYXWZPSUURHJ-UHFFFAOYSA-N
MW384.55 g/mol
LogP4.81
Rot. Bonds5

About N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide

N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide (PubChem CID 90595713) has the molecular formula C22H28N2O2S and a molecular weight of 384.55 g/mol. Its IUPAC name is N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
PubChem CID90595713
Molecular FormulaC22H28N2O2S
Molecular Weight384.55 g/mol
Exact Mass384.19
IUPAC NameN-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESCOC1CCN(c2ccc(NC(=O)C3(c4cccs4)CCCC3)cc2)CC1
InChIInChI=1S/C22H28N2O2S/c1-26-19-10-14-24(15-11-19)18-8-6-17(7-9-18)23-21(25)22(12-2-3-13-22)20-5-4-16-27-20/h4-9,16,19H,2-3,10-15H2,1H3,(H,23,25)
InChIKeyNATYXWZPSUURHJ-UHFFFAOYSA-N
XLogP4.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.55
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-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-[4-(4-methoxypiperidin-1-yl)phenyl]butanamide
CID 90595801
N-(4-acetylphenyl)-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698475
N-(2-methoxyphenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435562
2-cyano-N-[4-(4-methoxypiperidin-1-yl)phenyl]acetamide
CID 90595833
1-[4-(4-methoxypiperidin-1-yl)phenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 71809702
1-(1-adamantyl)-3-[4-(4-methoxypiperidin-1-yl)phenyl]urea
CID 90595914
N-[4-(4-methoxypiperidin-1-yl)phenyl]-4-methylthiophene-2-carboxamide
CID 71809641
N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435317
1-(2-methoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)cyclobutane-1-carboxamide
CID 110439047
(4-phenylpiperazin-1-yl)-(1-thiophen-2-ylcyclopentyl)methanone
CID 42390617
N-[4-(4-methoxypiperidin-1-yl)phenyl]-4-phenoxybenzamide
CID 90595819
N-(2-fluorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435427

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide?
The IUPAC name of N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide (CID 90595713) is N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide is COC1CCN(c2ccc(NC(=O)C3(c4cccs4)CCCC3)cc2)CC1.
What is the InChIKey of N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide?
The InChIKey is NATYXWZPSUURHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2S/c1-26-19-10-14-24(15-11-19)18-8-6-17(7-9-18)23-21(25)22(12-2-3-13-22)20-5-4-16-27-20/h4-9,16,19H,2-3,10-15H2,1H3,(H,23,25).
What are the key properties of N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide?
N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide has a molecular weight of 384.55 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methoxypiperidin-1-yl)phenyl]-1-thiophen-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 90595713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).