N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride

C12H19ClN2OS — CID 119385872

IUPACN-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NC1CCNCC1
InChIInChI=1S/C12H18N2OS.ClH/c15-12(2-1-10-5-8-16-9-10)14-11-3-6-13-7-4-11;/h5,8-9,11,13H,1-4,6-7H2,(H,14,15);1H
InChIKeyQMDMKKOVACYLDM-UHFFFAOYSA-N
MW274.82 g/mol
LogP1.97
Rot. Bonds4

About N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride

N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride (PubChem CID 119385872) has the molecular formula C12H19ClN2OS and a molecular weight of 274.82 g/mol. Its IUPAC name is N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride
PubChem CID119385872
Molecular FormulaC12H19ClN2OS
Molecular Weight274.82 g/mol
Exact Mass274.09
IUPAC NameN-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NC1CCNCC1
InChIInChI=1S/C12H18N2OS.ClH/c15-12(2-1-10-5-8-16-9-10)14-11-3-6-13-7-4-11;/h5,8-9,11,13H,1-4,6-7H2,(H,14,15);1H
InChIKeyQMDMKKOVACYLDM-UHFFFAOYSA-N
XLogP1.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.82
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-4-yl)-3-thiophen-3-ylpropanamide
CID 120601265
3-phenyl-N-piperidin-4-ylpropanamide
CID 16795625
cis-(1S,3R)-3-(3-thiophen-3-ylpropanoylamino)cyclopentane-1-carboxylic acid
CID 120676488
3-(4-methoxyphenyl)-N-piperidin-4-ylpropanamide;hydrochloride
CID 119388852
N-(2-methylpiperidin-4-yl)-2-thiophen-3-ylacetamide;hydrochloride
CID 120600805
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-thiophen-3-ylpropanamide
CID 16613440
N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
CID 119555094
N-[4-(methylamino)cyclohexyl]-2-thiophen-3-ylacetamide
CID 79111056
N-(2-methylpiperidin-4-yl)-2-thiophen-3-ylacetamide
CID 106995263
N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride
CID 119390755
N-(3-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-3-thiophen-3-ylpropanamide
CID 86772258
3-(3-methoxyphenyl)-N-piperidin-4-ylpropanamide
CID 119389634

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride?
The IUPAC name of N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride (CID 119385872) is N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride?
The canonical SMILES for N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride is Cl.O=C(CCc1ccsc1)NC1CCNCC1.
What is the InChIKey of N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride?
The InChIKey is QMDMKKOVACYLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS.ClH/c15-12(2-1-10-5-8-16-9-10)14-11-3-6-13-7-4-11;/h5,8-9,11,13H,1-4,6-7H2,(H,14,15);1H.
What are the key properties of N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride?
N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride has a molecular weight of 274.82 g/mol, XLogP of 1.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-3-thiophen-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119385872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).