N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide

C14H21NO2S — CID 6469294

IUPACN-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(=O)NC(C)C2CCCO2)cs1
InChIInChI=1S/C14H21NO2S/c1-3-5-12-8-11(9-18-12)14(16)15-10(2)13-6-4-7-17-13/h8-10,13H,3-7H2,1-2H3,(H,15,16)
InChIKeyZUXJPKWHCBBVGZ-UHFFFAOYSA-N
MW267.39 g/mol
LogP3.00
Rot. Bonds5

About N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide

N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide (PubChem CID 6469294) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide
PubChem CID6469294
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC NameN-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(=O)NC(C)C2CCCO2)cs1
InChIInChI=1S/C14H21NO2S/c1-3-5-12-8-11(9-18-12)14(16)15-10(2)13-6-4-7-17-13/h8-10,13H,3-7H2,1-2H3,(H,15,16)
InChIKeyZUXJPKWHCBBVGZ-UHFFFAOYSA-N
XLogP3.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-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

Related Compounds

5-methyl-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
CID 1247088
N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-5-propan-2-ylthiophene-3-carboxamide
CID 29037742
5-(3-aminoprop-1-ynyl)-N-[1-(oxolan-2-yl)ethyl]thiophene-3-carboxamide
CID 79696596
3-[4-[1-(oxolan-2-yl)ethylcarbamoyl]thiophen-2-yl]prop-2-enoic acid
CID 79683844
3,5-dimethyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]benzamide
CID 27233431
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
CID 35235171
4-ethyl-5-methyl-N-[1-(oxolan-2-yl)ethyl]thiophene-3-carboxamide
CID 6470285
5-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-2,5-dicarboxamide
CID 98786018
N-cyclopropyl-5-propylthiophene-3-carboxamide
CID 1244120
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
N-[1-(oxolan-2-yl)ethyl]-4-propan-2-ylbenzamide
CID 6468560
4-(chloromethyl)-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43533877

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide?
The IUPAC name of N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide (CID 6469294) is N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide.
What is the SMILES notation for N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide?
The canonical SMILES for N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide is CCCc1cc(C(=O)NC(C)C2CCCO2)cs1.
What is the InChIKey of N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide?
The InChIKey is ZUXJPKWHCBBVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-3-5-12-8-11(9-18-12)14(16)15-10(2)13-6-4-7-17-13/h8-10,13H,3-7H2,1-2H3,(H,15,16).
What are the key properties of N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide?
N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide has a molecular weight of 267.39 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide is sourced from PubChem (CID 6469294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).