4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride

C15H23ClN2O2S — CID 119823292

IUPAC4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1cc(C(C)=O)cs1)C1CCNCC1.Cl
InChIInChI=1S/C15H22N2O2S.ClH/c1-3-8-17(13-4-6-16-7-5-13)15(19)14-9-12(10-20-14)11(2)18;/h9-10,13,16H,3-8H2,1-2H3;1H
InChIKeyOURTVIQWZXOQJH-UHFFFAOYSA-N
MW330.88 g/mol
LogP2.98
Rot. Bonds5

About 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride

4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride (PubChem CID 119823292) has the molecular formula C15H23ClN2O2S and a molecular weight of 330.88 g/mol. Its IUPAC name is 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride
PubChem CID119823292
Molecular FormulaC15H23ClN2O2S
Molecular Weight330.88 g/mol
Exact Mass330.12
IUPAC Name4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1cc(C(C)=O)cs1)C1CCNCC1.Cl
InChIInChI=1S/C15H22N2O2S.ClH/c1-3-8-17(13-4-6-16-7-5-13)15(19)14-9-12(10-20-14)11(2)18;/h9-10,13,16H,3-8H2,1-2H3;1H
InChIKeyOURTVIQWZXOQJH-UHFFFAOYSA-N
XLogP2.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.88
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride
CID 119823220
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323
4-acetyl-1-methyl-N-piperidin-4-yl-N-propylpyrrole-2-carboxamide
CID 119823974
4-iodo-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119822992
3-chloro-N-piperidin-4-yl-N-propylthiophene-2-carboxamide
CID 80642602
4-ethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823008
2,5-dichloro-N-piperidin-4-yl-N-propylthiophene-3-carboxamide;hydrochloride
CID 119824416
N-piperidin-4-yl-5-propan-2-yl-N-propyl-1H-pyrazole-3-carboxamide
CID 119823212
N-piperidin-4-yl-N-propyl-1-benzothiophene-2-carboxamide
CID 61406378
2-(3-chlorophenyl)-N-piperidin-4-yl-N-propyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119824421
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3-[piperidin-4-yl(propyl)carbamoyl]benzoic acid
CID 61408528

Frequently Asked Questions

What is the IUPAC name of 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride?
The IUPAC name of 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride (CID 119823292) is 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride is CCCN(C(=O)c1cc(C(C)=O)cs1)C1CCNCC1.Cl.
What is the InChIKey of 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride?
The InChIKey is OURTVIQWZXOQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S.ClH/c1-3-8-17(13-4-6-16-7-5-13)15(19)14-9-12(10-20-14)11(2)18;/h9-10,13,16H,3-8H2,1-2H3;1H.
What are the key properties of 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride?
4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride has a molecular weight of 330.88 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119823292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).