N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide

C10H20N2OS — CID 63637616

IUPACN-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide
SMILESCCN(C(=O)CSC)C1CCCNC1
InChIInChI=1S/C10H20N2OS/c1-3-12(10(13)8-14-2)9-5-4-6-11-7-9/h9,11H,3-8H2,1-2H3
InChIKeyBKLLAWSXSMVBPS-UHFFFAOYSA-N
MW216.35 g/mol
LogP0.95
Rot. Bonds4

About N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide

N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide (PubChem CID 63637616) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide
PubChem CID63637616
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC NameN-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide
SMILESCCN(C(=O)CSC)C1CCCNC1
InChIInChI=1S/C10H20N2OS/c1-3-12(10(13)8-14-2)9-5-4-6-11-7-9/h9,11H,3-8H2,1-2H3
InChIKeyBKLLAWSXSMVBPS-UHFFFAOYSA-N
XLogP0.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-methylsulfanyl-N-piperidin-3-ylacetamide
CID 63642298
N-cyclopropyl-2-methylsulfanyl-N-(piperidin-3-ylmethyl)acetamide
CID 106628625
N-cyclopropyl-N-ethyl-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55249128
N-ethyl-N-piperidin-3-ylbut-2-ynamide
CID 107990351
N-ethyl-4-methyl-N-piperidin-3-ylpiperidine-1-carboxamide
CID 79160027
2-(3-ethoxycyclobutyl)-N-ethyl-N-piperidin-3-ylacetamide
CID 103162261
N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide
CID 60807405
2-cyclohexyl-N-ethyl-N-pyrrolidin-3-ylacetamide
CID 60807538
3-chloro-N-ethyl-N-pyrrolidin-3-ylpropanamide
CID 165439782
(3S)-N-cyclopentyl-N-ethylpiperidine-3-carboxamide
CID 81123267
(3R)-N-cyclopentyl-N-ethylpiperidine-3-carboxamide
CID 81123268
N-cyclohexyl-N-ethyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119923071

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide?
The IUPAC name of N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide (CID 63637616) is N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide.
What is the SMILES notation for N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide?
The canonical SMILES for N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide is CCN(C(=O)CSC)C1CCCNC1.
What is the InChIKey of N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide?
The InChIKey is BKLLAWSXSMVBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-3-12(10(13)8-14-2)9-5-4-6-11-7-9/h9,11H,3-8H2,1-2H3.
What are the key properties of N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide?
N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide has a molecular weight of 216.35 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methylsulfanyl-N-piperidin-3-ylacetamide is sourced from PubChem (CID 63637616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).