N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide

C13H19NO2S — CID 54994213

IUPACN-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H19NO2S/c1-10-6-9-17-12(10)13(16)14(7-8-15)11-4-2-3-5-11/h6,9,11,15H,2-5,7-8H2,1H3
InChIKeyBUAZLNNGUUETGE-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.43
Rot. Bonds4

About N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide

N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide (PubChem CID 54994213) has the molecular formula C13H19NO2S and a molecular weight of 253.37 g/mol. Its IUPAC name is N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide
PubChem CID54994213
Molecular FormulaC13H19NO2S
Molecular Weight253.37 g/mol
Exact Mass253.11
IUPAC NameN-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H19NO2S/c1-10-6-9-17-12(10)13(16)14(7-8-15)11-4-2-3-5-11/h6,9,11,15H,2-5,7-8H2,1H3
InChIKeyBUAZLNNGUUETGE-UHFFFAOYSA-N
XLogP2.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromopropyl)-N-cyclobutyl-3-methylthiophene-2-carboxamide
CID 102872297
3-bromo-N-cyclopentyl-N-(2-hydroxyethyl)thiophene-2-carboxamide
CID 63797804
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyl-3-methylthiophene-2-carboxamide
CID 54996464
3-methyl-N-piperidin-3-yl-N-propylthiophene-2-carboxamide
CID 63636574
N-cyclobutyl-3-ethyl-N-(3-hydroxypropyl)thiophene-2-carboxamide
CID 102867056
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
N-cyclopentyl-N-(2-hydroxyethyl)-3,5-dimethylbenzamide
CID 54993921
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-methylthiophene-2-carboxamide
CID 78814308
N-cyclohexyl-4-hydroxy-N-(2-hydroxyethyl)-2-methylbenzamide
CID 107671574
3-chloro-N-(2-chloroethyl)-N-cyclobutylthiophene-2-carboxamide
CID 102872856
N-cyclobutyl-4-hydroxy-N-(2-hydroxyethyl)-2-methylbenzamide
CID 102685018
N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 102684996

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide?
The IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide (CID 54994213) is N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide?
The canonical SMILES for N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide is Cc1ccsc1C(=O)N(CCO)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide?
The InChIKey is BUAZLNNGUUETGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2S/c1-10-6-9-17-12(10)13(16)14(7-8-15)11-4-2-3-5-11/h6,9,11,15H,2-5,7-8H2,1H3.
What are the key properties of N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide?
N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(2-hydroxyethyl)-3-methylthiophene-2-carboxamide is sourced from PubChem (CID 54994213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).