1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide

C18H26N2O2S — CID 124852026

IUPAC1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
SMILESCN(Cc1ccsc1)C(=O)C1CCN(C[C@H]2CCC=CO2)CC1
InChIInChI=1S/C18H26N2O2S/c1-19(12-15-7-11-23-14-15)18(21)16-5-8-20(9-6-16)13-17-4-2-3-10-22-17/h3,7,10-11,14,16-17H,2,4-6,8-9,12-13H2,1H3/t17-/m1/s1
InChIKeyUBWYYUGYCMJPDY-QGZVFWFLSA-N
MW334.48 g/mol
LogP3.11
Rot. Bonds5

About 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide

1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide (PubChem CID 124852026) has the molecular formula C18H26N2O2S and a molecular weight of 334.48 g/mol. Its IUPAC name is 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
PubChem CID124852026
Molecular FormulaC18H26N2O2S
Molecular Weight334.48 g/mol
Exact Mass334.17
IUPAC Name1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
SMILESCN(Cc1ccsc1)C(=O)C1CCN(C[C@H]2CCC=CO2)CC1
InChIInChI=1S/C18H26N2O2S/c1-19(12-15-7-11-23-14-15)18(21)16-5-8-20(9-6-16)13-17-4-2-3-10-22-17/h3,7,10-11,14,16-17H,2,4-6,8-9,12-13H2,1H3/t17-/m1/s1
InChIKeyUBWYYUGYCMJPDY-QGZVFWFLSA-N
XLogP3.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.48
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-(thiophen-3-ylmethyl)cyclohexanecarboxamide
CID 39966819
1-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl]piperidine-4-carboxylic acid
CID 43441613
N-methyl-1-(2-oxo-3H-1,3-oxazole-4-carbonyl)-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
CID 166309049
(3R)-1-cyclopropyl-N-methyl-5-oxo-N-(thiophen-3-ylmethyl)pyrrolidine-3-carboxamide
CID 94181767
N-[1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 124626949
2-(4-formylpiperidin-1-yl)-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 62654113
N-methyl-2-[4-(methylaminomethyl)piperidin-1-yl]-N-(thiophen-3-ylmethyl)acetamide
CID 63248532
N-[[3-(3,4-dihydro-2H-pyran-2-ylmethylamino)phenyl]methyl]-N-methylacetamide
CID 62066923
N-benzyl-N-methyl-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide
CID 1076502
2-methyl-1-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl]piperidine-4-carboxylic acid
CID 106744854
(3R)-7-methoxy-N-methyl-N-(thiophen-3-ylmethyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 95050038
N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide
CID 39966816

Frequently Asked Questions

What is the IUPAC name of 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide (CID 124852026) is 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide is CN(Cc1ccsc1)C(=O)C1CCN(C[C@H]2CCC=CO2)CC1.
What is the InChIKey of 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide?
The InChIKey is UBWYYUGYCMJPDY-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H26N2O2S/c1-19(12-15-7-11-23-14-15)18(21)16-5-8-20(9-6-16)13-17-4-2-3-10-22-17/h3,7,10-11,14,16-17H,2,4-6,8-9,12-13H2,1H3/t17-/m1/s1.
What are the key properties of 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide?
1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide has a molecular weight of 334.48 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]-N-methyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 124852026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).