4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide

C12H18N2O2S — CID 81122595

IUPAC4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
SMILESCOc1csc(C(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C12H18N2O2S/c1-14(9-3-5-13-6-4-9)12(15)11-7-10(16-2)8-17-11/h7-9,13H,3-6H2,1-2H3
InChIKeyWBRRKVILFLOGKI-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.58
Rot. Bonds3

About 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide

4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide (PubChem CID 81122595) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
PubChem CID81122595
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
SMILESCOc1csc(C(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C12H18N2O2S/c1-14(9-3-5-13-6-4-9)12(15)11-7-10(16-2)8-17-11/h7-9,13H,3-6H2,1-2H3
InChIKeyWBRRKVILFLOGKI-UHFFFAOYSA-N
XLogP1.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-methoxy-N-piperidin-4-ylthiophene-2-carboxamide
CID 167780143
4-methoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylthiophene-2-carboxamide
CID 81118506
N-(2-chlorocyclohexyl)-4-methoxy-N-methylthiophene-2-carboxamide
CID 102638182
4-methoxy-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-carboxamide
CID 81122974
3,5-dimethoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60805831
2,6-dimethoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602191
5-iodo-N-methyl-N-piperidin-4-ylthiophene-3-carboxamide;hydrochloride
CID 119441879
5-bromo-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 43602032
5-chloro-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 62277462
N-[(3-chlorocyclobutyl)methyl]-4-methoxy-N-methylthiophene-2-carboxamide
CID 81129766
4-methoxy-N-[(3R)-piperidin-3-yl]thiophene-2-carboxamide
CID 104645591
2-methoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602173

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide?
The IUPAC name of 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide (CID 81122595) is 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide?
The canonical SMILES for 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide is COc1csc(C(=O)N(C)C2CCNCC2)c1.
What is the InChIKey of 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide?
The InChIKey is WBRRKVILFLOGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-14(9-3-5-13-6-4-9)12(15)11-7-10(16-2)8-17-11/h7-9,13H,3-6H2,1-2H3.
What are the key properties of 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide?
4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide is sourced from PubChem (CID 81122595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).