N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide

C14H24N2OS — CID 114627232

IUPACN-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NC(C1CC1)C1CC1
InChIInChI=1S/C14H24N2OS/c17-13(9-18-12-5-7-15-8-6-12)16-14(10-1-2-10)11-3-4-11/h10-12,14-15H,1-9H2,(H,16,17)
InChIKeyJMVWHIIDMIBZDM-UHFFFAOYSA-N
MW268.43 g/mol
LogP1.78
Rot. Bonds6

About N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide

N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide (PubChem CID 114627232) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide
PubChem CID114627232
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NC(C1CC1)C1CC1
InChIInChI=1S/C14H24N2OS/c17-13(9-18-12-5-7-15-8-6-12)16-14(10-1-2-10)11-3-4-11/h10-12,14-15H,1-9H2,(H,16,17)
InChIKeyJMVWHIIDMIBZDM-UHFFFAOYSA-N
XLogP1.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-hydroxy-2-piperidin-4-ylsulfanylacetamide
CID 114627599
N-[(2S)-1-hydroxypropan-2-yl]-2-piperidin-4-ylsulfanylacetamide
CID 107219108
N-(1-hydroxypropan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114626594
N-[1-(dimethylamino)propan-2-yl]-2-piperidin-4-ylsulfanylacetamide
CID 114627957
N-(2-ethylbutyl)-2-piperidin-4-ylsulfanylacetamide
CID 114628110
methyl (2S)-3-methyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]butanoate
CID 104940371
N-pent-4-en-2-yl-2-piperidin-4-ylsulfanylacetamide
CID 114628059
N-(1-methoxy-3-methylbutan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114627675
N-(2,3-dihydroxypropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627744
2-methyl-6-[(2-piperidin-4-ylsulfanylacetyl)amino]heptanoic acid
CID 114627693
methyl 4-methyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]pentanoate
CID 114626748
1-piperidin-4-ylsulfanylpropan-2-one
CID 19936634

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide?
The IUPAC name of N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide (CID 114627232) is N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide?
The canonical SMILES for N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide is O=C(CSC1CCNCC1)NC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide?
The InChIKey is JMVWHIIDMIBZDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c17-13(9-18-12-5-7-15-8-6-12)16-14(10-1-2-10)11-3-4-11/h10-12,14-15H,1-9H2,(H,16,17).
What are the key properties of N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide?
N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide has a molecular weight of 268.43 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide is sourced from PubChem (CID 114627232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).