(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide

C10H19NO5S — CID 159843119

IUPAC(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide
SMILESCC(O)[C@H](C)C(=O)NC1CCCC1.O=S(=O)=O
InChIInChI=1S/C10H19NO2.O3S/c1-7(8(2)12)10(13)11-9-5-3-4-6-9;1-4(2)3/h7-9,12H,3-6H2,1-2H3,(H,11,13);/t7-,8?;/m0./s1
InChIKeyNOYBCTYIGTZSSC-JPPWUZRISA-N
MW265.33 g/mol
LogP0.06
Rot. Bonds3

About (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide

(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide (PubChem CID 159843119) has the molecular formula C10H19NO5S and a molecular weight of 265.33 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide
PubChem CID159843119
Molecular FormulaC10H19NO5S
Molecular Weight265.33 g/mol
Exact Mass265.10
IUPAC Name(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide
SMILESCC(O)[C@H](C)C(=O)NC1CCCC1.O=S(=O)=O
InChIInChI=1S/C10H19NO2.O3S/c1-7(8(2)12)10(13)11-9-5-3-4-6-9;1-4(2)3/h7-9,12H,3-6H2,1-2H3,(H,11,13);/t7-,8?;/m0./s1
InChIKeyNOYBCTYIGTZSSC-JPPWUZRISA-N
XLogP0.06
TPSA100.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,N'-di(cycloheptyl)-2,3-dihydroxybutanediamide
CID 141089668
N-cyclohexyl-2-silylpropanamide
CID 123581134
N-cyclopentyl-2-(methylamino)propanamide
CID 43083499
(2S)-N-cyclopentyl-2-(methylamino)propanamide
CID 28827015
N-cyclohexyl-2-(cyclooctylamino)propanamide
CID 43083622
2-(cycloheptylamino)-N-cyclohexylpropanamide
CID 43236394
N-cyclopentyl-2-(cyclopropylamino)propanamide
CID 43083564
N-cyclopentyl-2-methylbutanamide;methane
CID 159941857
N-cyclopentyl-2-methylsulfanylpropanamide
CID 126996006
2-(cyclohexylamino)-N-cyclopentylpropanamide
CID 43083335
(E)-N-cyclohexyl-2-hydroxypent-3-enamide
CID 130015263
N-cyclopentyl-2-(2-hydroxypropylamino)propanamide
CID 43389370

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide?
The IUPAC name of (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide (CID 159843119) is (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide.
What is the SMILES notation for (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide?
The canonical SMILES for (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide is CC(O)[C@H](C)C(=O)NC1CCCC1.O=S(=O)=O.
What is the InChIKey of (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide?
The InChIKey is NOYBCTYIGTZSSC-JPPWUZRISA-N. The full InChI is InChI=1S/C10H19NO2.O3S/c1-7(8(2)12)10(13)11-9-5-3-4-6-9;1-4(2)3/h7-9,12H,3-6H2,1-2H3,(H,11,13);/t7-,8?;/m0./s1.
What are the key properties of (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide?
(2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide has a molecular weight of 265.33 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-3-hydroxy-2-methylbutanamide;sulfur trioxide is sourced from PubChem (CID 159843119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).