(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide

C14H22N2OS — CID 9444129

IUPAC(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide
SMILESCC1CCN([C@H](C)C(=O)NCc2cccs2)CC1
InChIInChI=1S/C14H22N2OS/c1-11-5-7-16(8-6-11)12(2)14(17)15-10-13-4-3-9-18-13/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyQMASHVFMLXWIDK-GFCCVEGCSA-N
MW266.41 g/mol
LogP2.48
Rot. Bonds4

About (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide

(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide (PubChem CID 9444129) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide
PubChem CID9444129
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide
SMILESCC1CCN([C@H](C)C(=O)NCc2cccs2)CC1
InChIInChI=1S/C14H22N2OS/c1-11-5-7-16(8-6-11)12(2)14(17)15-10-13-4-3-9-18-13/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyQMASHVFMLXWIDK-GFCCVEGCSA-N
XLogP2.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(4-hydroxypiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide
CID 27070191
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 111543644
(2R)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-N-(thiophen-2-ylmethyl)propanamide
CID 27104700
(2S)-N-[(2-chlorophenyl)methyl]-2-(4-methylpiperidin-1-yl)propanamide
CID 9444015
2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(thiophen-2-ylmethyl)propanamide
CID 17447413
(2S)-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 30740454
(2R)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 9460133
2-[4-[1-(3-fluoroanilino)-1-oxopropan-2-yl]piperazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 60513034
ethyl (3S)-1-[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl]piperidine-3-carboxylate
CID 98490889
2-(3,5-dimethylpiperidin-1-yl)-N-(2-thiophen-2-ylethyl)propanamide
CID 75858751
(2S)-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 26300667
(2R)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 9493517

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide?
The IUPAC name of (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide (CID 9444129) is (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide.
What is the SMILES notation for (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide?
The canonical SMILES for (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide is CC1CCN([C@H](C)C(=O)NCc2cccs2)CC1.
What is the InChIKey of (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide?
The InChIKey is QMASHVFMLXWIDK-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-11-5-7-16(8-6-11)12(2)14(17)15-10-13-4-3-9-18-13/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,15,17)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide?
(2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide has a molecular weight of 266.41 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylpiperidin-1-yl)-N-(thiophen-2-ylmethyl)propanamide is sourced from PubChem (CID 9444129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).