N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide

C10H15NO2S — CID 115556536

IUPACN-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide
SMILESC#CCN(CC1CC1)S(=O)(=O)C1CC1
InChIInChI=1S/C10H15NO2S/c1-2-7-11(8-9-3-4-9)14(12,13)10-5-6-10/h1,9-10H,3-8H2
InChIKeyVJTDWKQCYOTQDJ-UHFFFAOYSA-N
MW213.30 g/mol
LogP0.82
Rot. Bonds5

About N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide

N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide (PubChem CID 115556536) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide
PubChem CID115556536
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC NameN-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide
SMILESC#CCN(CC1CC1)S(=O)(=O)C1CC1
InChIInChI=1S/C10H15NO2S/c1-2-7-11(8-9-3-4-9)14(12,13)10-5-6-10/h1,9-10H,3-8H2
InChIKeyVJTDWKQCYOTQDJ-UHFFFAOYSA-N
XLogP0.82
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(cyclopropylmethyl)-N-prop-2-ynylpyrrolidine-1-sulfonamide
CID 115556438
N-(cyclopropylmethyl)-N-prop-2-ynylpiperidine-1-sulfonamide
CID 115556534
[tert-butylsulfamoyl(prop-2-ynyl)amino]methylcyclopropane
CID 114812579
N-(cyclopropylmethyl)-N-prop-2-ynylbenzenesulfonamide
CID 80965589
[2-methylpropylsulfamoyl(prop-2-ynyl)amino]methylcyclopropane
CID 114816677
2-[cyclohexylsulfonyl(prop-2-ynyl)amino]acetic acid
CID 79275142
N-(cyclopropylmethyl)-2-propan-2-yloxy-N-prop-2-ynylethanesulfonamide
CID 115556523
5-amino-N-(cyclopropylmethyl)-N-prop-2-ynyl-1,3,4-thiadiazole-2-sulfonamide
CID 113383275
2,4-dibromo-N-(cyclopropylmethyl)-N-prop-2-ynylbenzenesulfonamide
CID 115556480
N-(cyclopropylmethyl)-2,4-dimethyl-N-prop-2-ynylbenzenesulfonamide
CID 113334751
2,5-dichloro-N-(cyclopropylmethyl)-N-prop-2-ynylthiophene-3-sulfonamide
CID 113334782
ethyl 3-[cyclopropylmethyl(prop-2-ynyl)sulfamoyl]propanoate
CID 113334772

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide (CID 115556536) is N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide is C#CCN(CC1CC1)S(=O)(=O)C1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide?
The InChIKey is VJTDWKQCYOTQDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-2-7-11(8-9-3-4-9)14(12,13)10-5-6-10/h1,9-10H,3-8H2.
What are the key properties of N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide?
N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide has a molecular weight of 213.30 g/mol, XLogP of 0.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-prop-2-ynylcyclopropanesulfonamide is sourced from PubChem (CID 115556536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).