N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide

C15H24N2OS — CID 47036203

IUPACN-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide
SMILESCC1CCN(CCNC(=O)CCc2ccsc2)CC1
InChIInChI=1S/C15H24N2OS/c1-13-4-8-17(9-5-13)10-7-16-15(18)3-2-14-6-11-19-12-14/h6,11-13H,2-5,7-10H2,1H3,(H,16,18)
InChIKeyHPPSEWSUHHNBLX-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.53
Rot. Bonds6

About N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide

N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide (PubChem CID 47036203) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide.

Molecular Properties

Compound NameN-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide
PubChem CID47036203
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC NameN-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide
SMILESCC1CCN(CCNC(=O)CCc2ccsc2)CC1
InChIInChI=1S/C15H24N2OS/c1-13-4-8-17(9-5-13)10-7-16-15(18)3-2-14-6-11-19-12-14/h6,11-13H,2-5,7-10H2,1H3,(H,16,18)
InChIKeyHPPSEWSUHHNBLX-UHFFFAOYSA-N
XLogP2.53
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(4-hydroxypiperidin-1-yl)propyl]-3-thiophen-3-ylpropanamide
CID 111429543
N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride
CID 119390755
4-methyl-N-(2-thiophen-3-ylethyl)piperidine-1-carboxamide
CID 52656985
N-[4-[3-(4-methylpiperidin-1-yl)propylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 35417013
2-methyl-1-[2-(4-methylpiperidin-1-yl)ethyl]-3-(thiophen-3-ylmethyl)guanidine;hydroiodide
CID 111940994
4-(3,4-dichlorophenyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]butanamide
CID 55883971
N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-3-thiophen-3-ylpropanamide
CID 39540383
3-methyl-1-(2-thiophen-3-ylethyl)pyrrolidine
CID 127001246
N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-thiophen-3-ylpropanamide
CID 38440769
N-[2-(methanesulfonamido)ethyl]-3-thiophen-3-ylpropanamide
CID 36905667
N-[2-[4-(pyrrolo[2,1-f][1,2,4]triazin-4-ylamino)piperidin-1-yl]ethyl]-4-thiophen-3-ylbutanamide
CID 146148293
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]-3-thiophen-3-ylpropanamide
CID 29299905

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide?
The IUPAC name of N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide (CID 47036203) is N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide.
What is the SMILES notation for N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide?
The canonical SMILES for N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide is CC1CCN(CCNC(=O)CCc2ccsc2)CC1.
What is the InChIKey of N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide?
The InChIKey is HPPSEWSUHHNBLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-13-4-8-17(9-5-13)10-7-16-15(18)3-2-14-6-11-19-12-14/h6,11-13H,2-5,7-10H2,1H3,(H,16,18).
What are the key properties of N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide?
N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide has a molecular weight of 280.44 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide is sourced from PubChem (CID 47036203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).