N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide

C10H19NO3S — CID 173297229

IUPACN-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide
SMILESC[C@H](C=O)N(C1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C10H19NO3S/c1-9(8-12)11(15(2,13)14)10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyHFTNAYXUTYLTQS-SECBINFHSA-N
MW233.33 g/mol
LogP1.17
Rot. Bonds4

About N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide

N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide (PubChem CID 173297229) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide
PubChem CID173297229
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC NameN-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide
SMILESC[C@H](C=O)N(C1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C10H19NO3S/c1-9(8-12)11(15(2,13)14)10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyHFTNAYXUTYLTQS-SECBINFHSA-N
XLogP1.17
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide?
The IUPAC name of N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide (CID 173297229) is N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide.
What is the SMILES notation for N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide?
The canonical SMILES for N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide is C[C@H](C=O)N(C1CCCCC1)S(C)(=O)=O.
What is the InChIKey of N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide?
The InChIKey is HFTNAYXUTYLTQS-SECBINFHSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-9(8-12)11(15(2,13)14)10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3/t9-/m1/s1.
What are the key properties of N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide?
N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide has a molecular weight of 233.33 g/mol, XLogP of 1.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[(2R)-1-oxopropan-2-yl]methanesulfonamide is sourced from PubChem (CID 173297229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).