N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide

C21H25N3O2S — CID 46156025

IUPACN-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
SMILESO=C(Cc1cccs1)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C21H25N3O2S/c25-20(14-17-4-3-13-27-17)22-16-9-11-24(12-10-16)19-6-2-1-5-18(19)21(26)23-15-7-8-15/h1-6,13,15-16H,7-12,14H2,(H,22,25)(H,23,26)
InChIKeyQFNKKVHWESABPT-UHFFFAOYSA-N
MW383.52 g/mol
LogP2.97
Rot. Bonds6

About N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide

N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide (PubChem CID 46156025) has the molecular formula C21H25N3O2S and a molecular weight of 383.52 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
PubChem CID46156025
Molecular FormulaC21H25N3O2S
Molecular Weight383.52 g/mol
Exact Mass383.17
IUPAC NameN-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
SMILESO=C(Cc1cccs1)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C21H25N3O2S/c25-20(14-17-4-3-13-27-17)22-16-9-11-24(12-10-16)19-6-2-1-5-18(19)21(26)23-15-7-8-15/h1-6,13,15-16H,7-12,14H2,(H,22,25)(H,23,26)
InChIKeyQFNKKVHWESABPT-UHFFFAOYSA-N
XLogP2.97
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.52
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]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-prop-2-enyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
CID 42848173
N-[1-[2-(4-acetylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 46038077
N-[1-[2-(cyclopropylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46156012
N-[1-[2-(4-propan-2-ylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 42848391
2-[[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 113083187
N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848047
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
N-[1-[2-(propylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46037540
N-cyclooctyl-2-thiophen-2-ylacetamide
CID 17256729
N-[1-[2-(prop-2-enylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46156126
N-[1-(4-oxopentanoyl)piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 108554283
N-[1-(3-methoxypropanoyl)piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 108554268

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide?
The IUPAC name of N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide (CID 46156025) is N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide?
The canonical SMILES for N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide is O=C(Cc1cccs1)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide?
The InChIKey is QFNKKVHWESABPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2S/c25-20(14-17-4-3-13-27-17)22-16-9-11-24(12-10-16)19-6-2-1-5-18(19)21(26)23-15-7-8-15/h1-6,13,15-16H,7-12,14H2,(H,22,25)(H,23,26).
What are the key properties of N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide?
N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide has a molecular weight of 383.52 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide is sourced from PubChem (CID 46156025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).