N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride

C14H23ClN2OS — CID 119555094

IUPACN-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NCCC1CCCNC1
InChIInChI=1S/C14H22N2OS.ClH/c17-14(4-3-13-6-9-18-11-13)16-8-5-12-2-1-7-15-10-12;/h6,9,11-12,15H,1-5,7-8,10H2,(H,16,17);1H
InChIKeyRHUFKMODQKPXSS-UHFFFAOYSA-N
MW302.87 g/mol
LogP2.61
Rot. Bonds6

About N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride

N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride (PubChem CID 119555094) has the molecular formula C14H23ClN2OS and a molecular weight of 302.87 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
PubChem CID119555094
Molecular FormulaC14H23ClN2OS
Molecular Weight302.87 g/mol
Exact Mass302.12
IUPAC NameN-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NCCC1CCCNC1
InChIInChI=1S/C14H22N2OS.ClH/c17-14(4-3-13-6-9-18-11-13)16-8-5-12-2-1-7-15-10-12;/h6,9,11-12,15H,1-5,7-8,10H2,(H,16,17);1H
InChIKeyRHUFKMODQKPXSS-UHFFFAOYSA-N
XLogP2.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.87
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-N-[2-[(3S)-piperidin-3-yl]ethyl]propanamide
CID 99776078
3-(2-thiophen-3-ylethyl)azepane
CID 104680659
N-(2-piperidin-3-ylethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide;hydrochloride
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3-(4-chlorophenyl)-N-(2-pyrrolidin-3-ylethyl)propanamide
CID 119534078
(3R)-N-(2-thiophen-3-ylethyl)piperidine-3-carboxamide
CID 81140487
2-(4-bromophenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557338
2-(4-methylphenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260712
2-(4-fluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 60894094
1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide
CID 54972057
2-piperidin-3-yl-N-(1-thiophen-3-ylpropan-2-yl)acetamide
CID 62676356
4-(2-phenylethoxy)-N-(2-piperidin-3-ylethyl)butanamide
CID 119556464
3-(5-phenyl-1,3-oxazol-2-yl)-N-(2-piperidin-3-ylethyl)propanamide;dihydrochloride
CID 119556270

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The IUPAC name of N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride (CID 119555094) is N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride is Cl.O=C(CCc1ccsc1)NCCC1CCCNC1.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The InChIKey is RHUFKMODQKPXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS.ClH/c17-14(4-3-13-6-9-18-11-13)16-8-5-12-2-1-7-15-10-12;/h6,9,11-12,15H,1-5,7-8,10H2,(H,16,17);1H.
What are the key properties of N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride?
N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride has a molecular weight of 302.87 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119555094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).