5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide

C11H14INO2S — CID 79692869

IUPAC5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide
SMILESCOC1CCCC1NC(=O)c1csc(I)c1
InChIInChI=1S/C11H14INO2S/c1-15-9-4-2-3-8(9)13-11(14)7-5-10(12)16-6-7/h5-6,8-9H,2-4H2,1H3,(H,13,14)
InChIKeyNOMOFCZTGIBASB-UHFFFAOYSA-N
MW351.21 g/mol
LogP2.65
Rot. Bonds3

About 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide

5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide (PubChem CID 79692869) has the molecular formula C11H14INO2S and a molecular weight of 351.21 g/mol. Its IUPAC name is 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide
PubChem CID79692869
Molecular FormulaC11H14INO2S
Molecular Weight351.21 g/mol
Exact Mass350.98
IUPAC Name5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide
SMILESCOC1CCCC1NC(=O)c1csc(I)c1
InChIInChI=1S/C11H14INO2S/c1-15-9-4-2-3-8(9)13-11(14)7-5-10(12)16-6-7/h5-6,8-9H,2-4H2,1H3,(H,13,14)
InChIKeyNOMOFCZTGIBASB-UHFFFAOYSA-N
XLogP2.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.21
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-[(1S,2S)-2-hydroxycyclohexyl]-5-iodothiophene-3-carboxamide
CID 104956640
N-(2-chlorocyclohexyl)-5-iodothiophene-3-carboxamide
CID 114301116
N-(2-methoxycyclopentyl)thiophene-2-carboxamide
CID 64592899
N-[2-(aminomethyl)cyclopentyl]-5-iodothiophene-3-carboxamide;hydrochloride
CID 119601552
3-amino-N-(2-methoxycyclopentyl)benzamide
CID 62086745
N-[2-(aminomethyl)cyclohexyl]-5-iodothiophene-3-carboxamide
CID 79692726
4-hydroxy-N-(2-methoxycyclopentyl)benzamide
CID 62087188
3-amino-4-methoxy-N-(2-methoxycyclopentyl)benzamide
CID 62088894
3-amino-4-bromo-N-(2-methoxycyclopentyl)benzamide
CID 62087821
3-cyano-N-(2-methoxycyclopentyl)benzamide
CID 62088957
3-[(5-iodothiophene-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 79685648
4-amino-N-(2-methoxycyclopentyl)pyridine-2-carboxamide
CID 62159962

Frequently Asked Questions

What is the IUPAC name of 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide?
The IUPAC name of 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide (CID 79692869) is 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide.
What is the SMILES notation for 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide?
The canonical SMILES for 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide is COC1CCCC1NC(=O)c1csc(I)c1.
What is the InChIKey of 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide?
The InChIKey is NOMOFCZTGIBASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14INO2S/c1-15-9-4-2-3-8(9)13-11(14)7-5-10(12)16-6-7/h5-6,8-9H,2-4H2,1H3,(H,13,14).
What are the key properties of 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide?
5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide has a molecular weight of 351.21 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-N-(2-methoxycyclopentyl)thiophene-3-carboxamide is sourced from PubChem (CID 79692869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).