5-propylthiophene-3-carboxamide

C8H11NOS — CID 141324975

IUPAC5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(N)=O)cs1
InChIInChI=1S/C8H11NOS/c1-2-3-7-4-6(5-11-7)8(9)10/h4-5H,2-3H2,1H3,(H2,9,10)
InChIKeyJICWMPUVQPWERU-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.80
Rot. Bonds3

About 5-propylthiophene-3-carboxamide

5-propylthiophene-3-carboxamide (PubChem CID 141324975) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 5-propylthiophene-3-carboxamide.

Molecular Properties

Compound Name5-propylthiophene-3-carboxamide
PubChem CID141324975
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(N)=O)cs1
InChIInChI=1S/C8H11NOS/c1-2-3-7-4-6(5-11-7)8(9)10/h4-5H,2-3H2,1H3,(H2,9,10)
InChIKeyJICWMPUVQPWERU-UHFFFAOYSA-N
XLogP1.80
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(aminomethyl)thiophene-3-carboxamide;hydrochloride
CID 163226135
5-(butylaminomethyl)thiophene-3-carboxamide
CID 79606629
5-[(pentan-3-ylamino)methyl]thiophene-3-carboxamide
CID 79605956
N-cyclopropyl-5-propylthiophene-3-carboxamide
CID 1244120
5-[[[1-(ethylamino)-1-oxopropan-2-yl]amino]methyl]thiophene-3-carboxamide
CID 79614506
5-[(heptan-2-ylamino)methyl]thiophene-3-carboxamide
CID 79614425
[(2S,6S)-2,6-dimethylmorpholin-4-yl]-(5-propylthiophen-3-yl)methanone
CID 27233404
1-(5-ethylthiophen-3-yl)butan-1-one
CID 158760441
methyl (2S)-2-[(4-carbamoylthiophen-2-yl)methylamino]propanoate
CID 79613507
5-[(3-butoxypropylamino)methyl]thiophene-3-carboxamide
CID 115735466
5-[[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]methyl]thiophene-3-carboxamide
CID 104923448
5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide
CID 115735684

Frequently Asked Questions

What is the IUPAC name of 5-propylthiophene-3-carboxamide?
The IUPAC name of 5-propylthiophene-3-carboxamide (CID 141324975) is 5-propylthiophene-3-carboxamide.
What is the SMILES notation for 5-propylthiophene-3-carboxamide?
The canonical SMILES for 5-propylthiophene-3-carboxamide is CCCc1cc(C(N)=O)cs1.
What is the InChIKey of 5-propylthiophene-3-carboxamide?
The InChIKey is JICWMPUVQPWERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-2-3-7-4-6(5-11-7)8(9)10/h4-5H,2-3H2,1H3,(H2,9,10).
What are the key properties of 5-propylthiophene-3-carboxamide?
5-propylthiophene-3-carboxamide has a molecular weight of 169.25 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propylthiophene-3-carboxamide is sourced from PubChem (CID 141324975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).