N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide

C18H20N2O2S — CID 162698084

IUPACN-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1)c1ccc(C(=O)N2CCCC2)s1
InChIInChI=1S/C18H20N2O2S/c1-13(19-17(21)14-7-3-2-4-8-14)15-9-10-16(23-15)18(22)20-11-5-6-12-20/h2-4,7-10,13H,5-6,11-12H2,1H3,(H,19,21)
InChIKeyOOKHPCOBIAOCPN-UHFFFAOYSA-N
MW328.44 g/mol
LogP3.48
Rot. Bonds4

About N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide

N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide (PubChem CID 162698084) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide
PubChem CID162698084
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC NameN-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1)c1ccc(C(=O)N2CCCC2)s1
InChIInChI=1S/C18H20N2O2S/c1-13(19-17(21)14-7-3-2-4-8-14)15-9-10-16(23-15)18(22)20-11-5-6-12-20/h2-4,7-10,13H,5-6,11-12H2,1H3,(H,19,21)
InChIKeyOOKHPCOBIAOCPN-UHFFFAOYSA-N
XLogP3.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide 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-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide
CID 70036807
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
1-N,3-N-bis[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzene-1,3-dicarboxamide
CID 11090985
N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-1-carboxamide
CID 113226653
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide
CID 109047024
N-[(1S)-1-(1-benzoylpiperidin-4-yl)-2-oxo-2-piperidin-1-ylethyl]benzamide
CID 93199232
(5-methylthiophen-2-yl)-piperidin-1-ylmethanone
CID 22375343
N-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]acetamide
CID 60705923
4-benzoyl-N-(1-thiophen-2-ylethyl)benzamide
CID 17431646
N-[1-[1-(2-methylpropanoyl)piperidin-4-yl]-2-oxo-2-piperidin-1-ylethyl]benzamide
CID 46020232
N-[4-(4-benzoylpiperazin-1-yl)-4-oxobutan-2-yl]benzamide
CID 78804572
4-(4-phenylpiperazine-1-carbonyl)-N-propan-2-ylbenzamide
CID 109043114

Frequently Asked Questions

What is the IUPAC name of N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide?
The IUPAC name of N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide (CID 162698084) is N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide.
What is the SMILES notation for N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide?
The canonical SMILES for N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide is CC(NC(=O)c1ccccc1)c1ccc(C(=O)N2CCCC2)s1.
What is the InChIKey of N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide?
The InChIKey is OOKHPCOBIAOCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c1-13(19-17(21)14-7-3-2-4-8-14)15-9-10-16(23-15)18(22)20-11-5-6-12-20/h2-4,7-10,13H,5-6,11-12H2,1H3,(H,19,21).
What are the key properties of N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide?
N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide has a molecular weight of 328.44 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide is sourced from PubChem (CID 162698084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).