3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide

C19H24N2OS — CID 17011590

IUPAC3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide
SMILESCc1cccc(C(=O)NCC(c2cccs2)N2CCCCC2)c1
InChIInChI=1S/C19H24N2OS/c1-15-7-5-8-16(13-15)19(22)20-14-17(18-9-6-12-23-18)21-10-3-2-4-11-21/h5-9,12-13,17H,2-4,10-11,14H2,1H3,(H,20,22)
InChIKeyPZCPZPZBJAZLGJ-UHFFFAOYSA-N
MW328.48 g/mol
LogP4.01
Rot. Bonds5

About 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide

3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide (PubChem CID 17011590) has the molecular formula C19H24N2OS and a molecular weight of 328.48 g/mol. Its IUPAC name is 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide
PubChem CID17011590
Molecular FormulaC19H24N2OS
Molecular Weight328.48 g/mol
Exact Mass328.16
IUPAC Name3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide
SMILESCc1cccc(C(=O)NCC(c2cccs2)N2CCCCC2)c1
InChIInChI=1S/C19H24N2OS/c1-15-7-5-8-16(13-15)19(22)20-14-17(18-9-6-12-23-18)21-10-3-2-4-11-21/h5-9,12-13,17H,2-4,10-11,14H2,1H3,(H,20,22)
InChIKeyPZCPZPZBJAZLGJ-UHFFFAOYSA-N
XLogP4.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.48
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide
CID 17012410
N-[(2R)-2-piperidin-1-yl-2-thiophen-2-ylethyl]benzamide
CID 34950040
N-[(2S)-2-(azepan-1-yl)-2-thiophen-2-ylethyl]benzamide
CID 35042267
3-chloro-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]benzamide
CID 34951917
3-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzamide
CID 45155327
3-ethoxy-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide
CID 43843143
3-methoxy-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984511
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethyl]-3-methylbenzamide
CID 18577850
3-methyl-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43842823
N-[(2R)-2-(azepan-1-yl)-2-thiophen-2-ylethyl]-3-butoxybenzamide
CID 35042150
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-methylbenzamide
CID 26834257
N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]-3,5-dimethoxybenzamide
CID 112504783

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide (CID 17011590) is 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide is Cc1cccc(C(=O)NCC(c2cccs2)N2CCCCC2)c1.
What is the InChIKey of 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide?
The InChIKey is PZCPZPZBJAZLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2OS/c1-15-7-5-8-16(13-15)19(22)20-14-17(18-9-6-12-23-18)21-10-3-2-4-11-21/h5-9,12-13,17H,2-4,10-11,14H2,1H3,(H,20,22).
What are the key properties of 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide?
3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide has a molecular weight of 328.48 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 17011590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).