3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide

C14H22N2OS — CID 60547129

IUPAC3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide
SMILESCCC(NC(=O)N1CCCC(C)C1)c1cccs1
InChIInChI=1S/C14H22N2OS/c1-3-12(13-7-5-9-18-13)15-14(17)16-8-4-6-11(2)10-16/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3,(H,15,17)
InChIKeyRWGQCSPQFGFEFM-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.64
Rot. Bonds3

About 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide

3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide (PubChem CID 60547129) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide
PubChem CID60547129
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide
SMILESCCC(NC(=O)N1CCCC(C)C1)c1cccs1
InChIInChI=1S/C14H22N2OS/c1-3-12(13-7-5-9-18-13)15-14(17)16-8-4-6-11(2)10-16/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3,(H,15,17)
InChIKeyRWGQCSPQFGFEFM-UHFFFAOYSA-N
XLogP3.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(2S)-oxolan-2-yl]-N-[(1S)-1-thiophen-2-ylpropyl]morpholine-4-carboxamide
CID 97096465
3-piperidin-1-yl-N-[(1S)-1-thiophen-2-ylpropyl]azetidine-1-carboxamide
CID 126425885
(3R,4R)-3-methoxy-4-methyl-N-[(1S)-1-thiophen-2-ylpropyl]piperidine-1-carboxamide
CID 129431123
3-N-(1,3-thiazol-2-yl)-1-N-(1-thiophen-2-ylpropyl)piperidine-1,3-dicarboxamide
CID 55931373
4-(oxan-4-yl)-N-[(1R)-1-thiophen-2-ylpropyl]piperazine-1-carboxamide
CID 124608917
4-methyl-1-(1-thiophen-2-ylpropylcarbamoyl)piperidine-2-carboxylic acid
CID 114425398
2-thiophen-3-yl-N-(1-thiophen-2-ylpropyl)morpholine-4-carboxamide
CID 75379628
4-pyrimidin-2-yl-N-(1-thiophen-2-ylpropyl)piperazine-1-carboxamide
CID 60547485
4-(2-methylpyrazol-3-yl)-N-[(1S)-1-thiophen-2-ylpropyl]piperidine-1-carboxamide
CID 124607053
1-pyrrolidin-1-yl-2-(1-thiophen-2-ylpropylamino)ethanone
CID 54964322
4-(1H-imidazol-5-yl)-N-[(1S)-1-thiophen-2-ylpropyl]piperidine-1-carboxamide
CID 124890430
(2R)-2-(2-methyl-1,3-thiazol-4-yl)-N-[(1S)-1-thiophen-2-ylpropyl]pyrrolidine-1-carboxamide
CID 124622224

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide (CID 60547129) is 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide is CCC(NC(=O)N1CCCC(C)C1)c1cccs1.
What is the InChIKey of 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The InChIKey is RWGQCSPQFGFEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-3-12(13-7-5-9-18-13)15-14(17)16-8-4-6-11(2)10-16/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3,(H,15,17).
What are the key properties of 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide?
3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide is sourced from PubChem (CID 60547129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).