4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide

C12H18N2OS — CID 79808514

IUPAC4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
SMILESCc1cscc1C(=O)NCC1CCNCC1
InChIInChI=1S/C12H18N2OS/c1-9-7-16-8-11(9)12(15)14-6-10-2-4-13-5-3-10/h7-8,10,13H,2-6H2,1H3,(H,14,15)
InChIKeyWYMIKQPAWAPZQT-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.79
Rot. Bonds3

About 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide

4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide (PubChem CID 79808514) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
PubChem CID79808514
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
SMILESCc1cscc1C(=O)NCC1CCNCC1
InChIInChI=1S/C12H18N2OS/c1-9-7-16-8-11(9)12(15)14-6-10-2-4-13-5-3-10/h7-8,10,13H,2-6H2,1H3,(H,14,15)
InChIKeyWYMIKQPAWAPZQT-UHFFFAOYSA-N
XLogP1.79
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(4-methylthiophene-3-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79803145
N-[(3-chlorocyclopentyl)methyl]-4-methylthiophene-3-carboxamide
CID 106126254
2,5-dimethyl-N-(piperidin-4-ylmethyl)furan-3-carboxamide
CID 60725294
3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 82829222
1,3-dimethyl-N-(piperidin-4-ylmethyl)pyrazole-4-carboxamide
CID 103805401
2,4,5-trimethyl-N-(pyrrolidin-3-ylmethyl)benzamide
CID 115271836
2,5-dichloro-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
CID 103805410
4-hydroxy-3-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 107671970
5-methyl-2-nitro-N-(piperidin-4-ylmethyl)benzamide
CID 65461649
2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
CID 43152403
N-(cyclopropylmethyl)-2-methyl-3-piperidin-4-ylbenzamide
CID 171362054
2,4-dibromo-N-(piperidin-4-ylmethyl)benzamide
CID 114018481

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide?
The IUPAC name of 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide (CID 79808514) is 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide.
What is the SMILES notation for 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide?
The canonical SMILES for 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide is Cc1cscc1C(=O)NCC1CCNCC1.
What is the InChIKey of 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide?
The InChIKey is WYMIKQPAWAPZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-9-7-16-8-11(9)12(15)14-6-10-2-4-13-5-3-10/h7-8,10,13H,2-6H2,1H3,(H,14,15).
What are the key properties of 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide?
4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide has a molecular weight of 238.36 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide is sourced from PubChem (CID 79808514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).