N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide

C9H19NO2S — CID 95761810

IUPACN-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)N[C@H](C)C1CC1
InChIInChI=1S/C9H19NO2S/c1-3-4-7-13(11,12)10-8(2)9-5-6-9/h8-10H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyRBYGQVYCQWZUFL-MRVPVSSYSA-N
MW205.32 g/mol
LogP1.50
Rot. Bonds6

About N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide

N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide (PubChem CID 95761810) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide
PubChem CID95761810
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)N[C@H](C)C1CC1
InChIInChI=1S/C9H19NO2S/c1-3-4-7-13(11,12)10-8(2)9-5-6-9/h8-10H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyRBYGQVYCQWZUFL-MRVPVSSYSA-N
XLogP1.50
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-pyrrolidin-3-ylethyl)butane-1-sulfonamide
CID 103976958
N-(1-piperidin-3-ylethyl)butane-1-sulfonamide
CID 43523463
N-(1-cyclopentylethyl)-4-(methylamino)butane-1-sulfonamide
CID 106066011
N-(1-cyclopentylethyl)-2-(propylamino)ethanesulfonamide
CID 106066112
N-[(1R)-1-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]butane-1-sulfonamide
CID 98297363
1-chloro-N-(1-cyclopropylethyl)methanesulfonamide
CID 63663866
3-(ethylamino)-N-[1-(oxan-4-yl)ethyl]propane-1-sulfonamide
CID 114142621
4-(1-cyclohexylethylsulfamoyl)butanoic acid
CID 62406651
N-(1-hydroxypropan-2-yl)butane-1-sulfonamide
CID 43502189
N-(1-propan-2-ylpiperidin-4-yl)butane-1-sulfonamide
CID 22772688
(2R)-2-(butylsulfonylamino)propanoate
CID 2447741
N-(1-chloro-4-methylpentan-2-yl)butane-1-sulfonamide
CID 65031040

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide?
The IUPAC name of N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide (CID 95761810) is N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide.
What is the SMILES notation for N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide?
The canonical SMILES for N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide is CCCCS(=O)(=O)N[C@H](C)C1CC1.
What is the InChIKey of N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide?
The InChIKey is RBYGQVYCQWZUFL-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-3-4-7-13(11,12)10-8(2)9-5-6-9/h8-10H,3-7H2,1-2H3/t8-/m1/s1.
What are the key properties of N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide?
N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopropylethyl]butane-1-sulfonamide is sourced from PubChem (CID 95761810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).