N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide

C13H20N2OS — CID 107067215

IUPACN,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C13H20N2OS/c1-10-4-3-6-14-12(10)13(16)15(2)8-11-5-7-17-9-11/h5,7,9-10,12,14H,3-4,6,8H2,1-2H3
InChIKeyFCJGAFYRMBIZGT-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.09
Rot. Bonds3

About N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide

N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide (PubChem CID 107067215) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide
PubChem CID107067215
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC NameN,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C13H20N2OS/c1-10-4-3-6-14-12(10)13(16)15(2)8-11-5-7-17-9-11/h5,7,9-10,12,14H,3-4,6,8H2,1-2H3
InChIKeyFCJGAFYRMBIZGT-UHFFFAOYSA-N
XLogP2.09
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(thiophen-3-ylmethyl)cyclohexanecarboxamide
CID 39966819
N-[(3-methoxyphenyl)methyl]-N,3-dimethylpiperidine-2-carboxamide
CID 62339975
N,N-dibenzyl-3-methylpiperidine-2-carboxamide
CID 130158118
N-[(2,4-dichlorophenyl)methyl]-N,3-dimethylpiperidine-2-carboxamide
CID 107067660
N-methyl-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)-N-(thiophen-3-ylmethyl)acetamide
CID 62273221
N-methyl-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]-N-(thiophen-3-ylmethyl)acetamide
CID 106614772
2-[azepan-4-yl(methyl)amino]-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 104979626
N-[(4-chlorophenyl)methyl]-N-cyclopropyl-3-methylpiperidine-2-carboxamide
CID 107067678
N-methyl-N-[[(2S)-piperidin-2-yl]methyl]-2-thiophen-3-ylacetamide
CID 97164135
N,N-bis(2-hydroxyethyl)-3-methylpiperidine-2-carboxamide
CID 62339294
N-cyclopropyl-N-(thiophen-3-ylmethyl)carbamoyl chloride
CID 79887165
2-[azetidin-3-yl(methyl)amino]-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 66186907

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide (CID 107067215) is N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide is CC1CCCNC1C(=O)N(C)Cc1ccsc1.
What is the InChIKey of N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide?
The InChIKey is FCJGAFYRMBIZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-10-4-3-6-14-12(10)13(16)15(2)8-11-5-7-17-9-11/h5,7,9-10,12,14H,3-4,6,8H2,1-2H3.
What are the key properties of N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide?
N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide has a molecular weight of 252.38 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-(thiophen-3-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 107067215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).