N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide

C14H21NO2S — CID 7243570

IUPACN-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide
SMILESCC(C)CNC(=O)C1(c2cccs2)CCOCC1
InChIInChI=1S/C14H21NO2S/c1-11(2)10-15-13(16)14(5-7-17-8-6-14)12-4-3-9-18-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,15,16)
InChIKeyHXVKTXXYXOTWKM-UHFFFAOYSA-N
MW267.39 g/mol
LogP2.57
Rot. Bonds4

About N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide

N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide (PubChem CID 7243570) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide
PubChem CID7243570
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC NameN-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide
SMILESCC(C)CNC(=O)C1(c2cccs2)CCOCC1
InChIInChI=1S/C14H21NO2S/c1-11(2)10-15-13(16)14(5-7-17-8-6-14)12-4-3-9-18-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,15,16)
InChIKeyHXVKTXXYXOTWKM-UHFFFAOYSA-N
XLogP2.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-methylpropyl)-4-thiophen-2-yloxane-4-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-fluorobenzyl)-4-(thiophen-2-yl)tetrahydro-2H-pyran-4-carboxamide
CID 7243529
N-isopentyl-4-(thiophen-2-yl)tetrahydro-2H-pyran-4-carboxamide
CID 7217405
N-(4-methylbenzyl)-4-(thiophen-2-yl)tetrahydro-2H-pyran-4-carboxamide
CID 7243515
N-(1-phenylethyl)-4-(thiophen-2-yl)tetrahydro-2H-pyran-4-carboxamide
CID 12005899
N-(3-Butoxypropyl)-2-(2-thienyl)acetamide
CID 2162137
N-(3-ethoxypropyl)-2-(2-thienyl)acetamide
CID 3668870
2-((4-fluorophenyl)thio)-N-((4-(thiophen-2-yl)tetrahydro-2H-pyran-4-yl)methyl)acetamide
CID 45561710
N-[(4-Methyloxan-4-YL)methyl]thiophene-2-carboxamide
CID 103742554
N-(2-ethylhexyl)-2-(2-thienyl)acetamide
CID 2916095
N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide
CID 2474427
1-(4-Thiophen-2-yloxane-4-carbonyl)piperidine-4-carboxamide
CID 7217398
1-[4-(4-Thiophen-2-yloxane-4-carbonyl)piperazin-1-yl]ethanone
CID 7243499

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide?
The IUPAC name of N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide (CID 7243570) is N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide is CC(C)CNC(=O)C1(c2cccs2)CCOCC1.
What is the InChIKey of N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide?
The InChIKey is HXVKTXXYXOTWKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-11(2)10-15-13(16)14(5-7-17-8-6-14)12-4-3-9-18-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,15,16).
What are the key properties of N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide?
N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide has a molecular weight of 267.39 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-4-thiophen-2-yloxane-4-carboxamide is sourced from PubChem (CID 7243570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).