N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide

C9H15NO2S — CID 123356995

IUPACN-(2-methylidenepent-3-enyl)cyclopropanesulfonamide
SMILESC=C(C=CC)CNS(=O)(=O)C1CC1
InChIInChI=1S/C9H15NO2S/c1-3-4-8(2)7-10-13(11,12)9-5-6-9/h3-4,9-10H,2,5-7H2,1H3
InChIKeyLWEOIKCJWPKNGW-UHFFFAOYSA-N
MW201.29 g/mol
LogP1.20
Rot. Bonds5

About N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide

N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide (PubChem CID 123356995) has the molecular formula C9H15NO2S and a molecular weight of 201.29 g/mol. Its IUPAC name is N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-methylidenepent-3-enyl)cyclopropanesulfonamide
PubChem CID123356995
Molecular FormulaC9H15NO2S
Molecular Weight201.29 g/mol
Exact Mass201.08
IUPAC NameN-(2-methylidenepent-3-enyl)cyclopropanesulfonamide
SMILESC=C(C=CC)CNS(=O)(=O)C1CC1
InChIInChI=1S/C9H15NO2S/c1-3-4-8(2)7-10-13(11,12)9-5-6-9/h3-4,9-10H,2,5-7H2,1H3
InChIKeyLWEOIKCJWPKNGW-UHFFFAOYSA-N
XLogP1.20
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide?
The IUPAC name of N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide (CID 123356995) is N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide is C=C(C=CC)CNS(=O)(=O)C1CC1.
What is the InChIKey of N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide?
The InChIKey is LWEOIKCJWPKNGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2S/c1-3-4-8(2)7-10-13(11,12)9-5-6-9/h3-4,9-10H,2,5-7H2,1H3.
What are the key properties of N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide?
N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide has a molecular weight of 201.29 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylidenepent-3-enyl)cyclopropanesulfonamide is sourced from PubChem (CID 123356995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).