N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide

C15H24N2OS — CID 62675416

IUPACN-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide
SMILESCc1cc(C(C)NC(=O)CC2CCCNC2)c(C)s1
InChIInChI=1S/C15H24N2OS/c1-10-7-14(12(3)19-10)11(2)17-15(18)8-13-5-4-6-16-9-13/h7,11,13,16H,4-6,8-9H2,1-3H3,(H,17,18)
InChIKeyGBVQAVVUIZLPKF-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.93
Rot. Bonds4

About N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide

N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide (PubChem CID 62675416) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide
PubChem CID62675416
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC NameN-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide
SMILESCc1cc(C(C)NC(=O)CC2CCCNC2)c(C)s1
InChIInChI=1S/C15H24N2OS/c1-10-7-14(12(3)19-10)11(2)17-15(18)8-13-5-4-6-16-9-13/h7,11,13,16H,4-6,8-9H2,1-3H3,(H,17,18)
InChIKeyGBVQAVVUIZLPKF-UHFFFAOYSA-N
XLogP2.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-4-ylacetamide
CID 54910487
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61372761
2-(cyclopropylmethylamino)-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]acetamide
CID 60866013
N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 81356926
N-[(1R)-1-phenylethyl]-2-piperidin-3-ylacetamide
CID 78953201
N-[1-(3-hydroxyphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62676485
2-(azetidin-3-yl)-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]propanamide
CID 116675057
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-piperidin-3-ylacetamide
CID 65241372
2-piperidin-3-yl-N-(1-thiophen-3-ylpropan-2-yl)acetamide
CID 62676356
1,3-bis[1-(2,5-dimethylthiophen-3-yl)ethyl]urea
CID 71897547
methyl (2S)-3-methyl-2-[(2-piperidin-3-ylacetyl)amino]butanoate
CID 62675949
2-cyclobutyl-N-(1-piperidin-3-ylethyl)acetamide
CID 103806063

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide (CID 62675416) is N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide is Cc1cc(C(C)NC(=O)CC2CCCNC2)c(C)s1.
What is the InChIKey of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide?
The InChIKey is GBVQAVVUIZLPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-10-7-14(12(3)19-10)11(2)17-15(18)8-13-5-4-6-16-9-13/h7,11,13,16H,4-6,8-9H2,1-3H3,(H,17,18).
What are the key properties of N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide?
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide has a molecular weight of 280.44 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62675416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).