N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide

C14H22N2OS — CID 43696619

IUPACN-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide
SMILESCc1cc(C(C)NC(=O)C2CCCNC2)c(C)s1
InChIInChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)16-14(17)12-5-4-6-15-8-12/h7,10,12,15H,4-6,8H2,1-3H3,(H,16,17)
InChIKeyDDFMSSLPMKBESD-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.54
Rot. Bonds3

About N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide

N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide (PubChem CID 43696619) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide
PubChem CID43696619
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide
SMILESCc1cc(C(C)NC(=O)C2CCCNC2)c(C)s1
InChIInChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)16-14(17)12-5-4-6-15-8-12/h7,10,12,15H,4-6,8H2,1-3H3,(H,16,17)
InChIKeyDDFMSSLPMKBESD-UHFFFAOYSA-N
XLogP2.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-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 N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide (CID 43696619) is N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide is Cc1cc(C(C)NC(=O)C2CCCNC2)c(C)s1.
What is the InChIKey of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is DDFMSSLPMKBESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-9-7-13(11(3)18-9)10(2)16-14(17)12-5-4-6-15-8-12/h7,10,12,15H,4-6,8H2,1-3H3,(H,16,17).
What are the key properties of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide?
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 43696619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).