N-cyclopropyl-1-phenylmethanesulfonamide

C10H13NO2S — CID 4083693

IUPACN-cyclopropyl-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NC1CC1
InChIInChI=1S/C10H13NO2S/c12-14(13,11-10-6-7-10)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
InChIKeyJSBKYOUDFPFYDR-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.27
Rot. Bonds4

About N-cyclopropyl-1-phenylmethanesulfonamide

N-cyclopropyl-1-phenylmethanesulfonamide (PubChem CID 4083693) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-cyclopropyl-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-1-phenylmethanesulfonamide
PubChem CID4083693
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-cyclopropyl-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NC1CC1
InChIInChI=1S/C10H13NO2S/c12-14(13,11-10-6-7-10)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
InChIKeyJSBKYOUDFPFYDR-UHFFFAOYSA-N
XLogP1.27
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-methylbenzene-1-sulfonamide
CID 4190095
{[(Benzylsulfonyl)amino]methyl}boronic Acid
CID 49837085
N-Phenethylmethanesulfonamide
CID 118569
4-methyl-N-pentan-2-ylbenzenesulfonamide
CID 3703019
N-methyl-1-phenylmethanesulfonamide
CID 290582
N-(4-phenylbutyl)ethanesulfonamide
CID 2179616
N-(3-phenylpropyl)ethanesulfonamide
CID 2167095
N-[2-(benzylsulfanyl)ethyl]methanesulfonamide
CID 2197817
N-Methyl-2-phenylethene-1-sulfonamide
CID 2427246
N-(3-phenylpropyl)methanesulfonamide
CID 1744854
p-Toluenesulfonamide, N-sec-butyl-
CID 211876
4-methyl-N-(propan-2-yl)benzene-1-sulfonamide
CID 4329528

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-phenylmethanesulfonamide?
The IUPAC name of N-cyclopropyl-1-phenylmethanesulfonamide (CID 4083693) is N-cyclopropyl-1-phenylmethanesulfonamide.
What is the SMILES notation for N-cyclopropyl-1-phenylmethanesulfonamide?
The canonical SMILES for N-cyclopropyl-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)NC1CC1.
What is the InChIKey of N-cyclopropyl-1-phenylmethanesulfonamide?
The InChIKey is JSBKYOUDFPFYDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c12-14(13,11-10-6-7-10)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2.
What are the key properties of N-cyclopropyl-1-phenylmethanesulfonamide?
N-cyclopropyl-1-phenylmethanesulfonamide has a molecular weight of 211.29 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-phenylmethanesulfonamide is sourced from PubChem (CID 4083693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).