1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide

C7H15NO3S — CID 138583497

IUPAC1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide
SMILESCC(C)NS(=O)(=O)C1(CO)CC1
InChIInChI=1S/C7H15NO3S/c1-6(2)8-12(10,11)7(5-9)3-4-7/h6,8-9H,3-5H2,1-2H3
InChIKeyQMFZRPGDTWXBFO-UHFFFAOYSA-N
MW193.27 g/mol
LogP-0.16
Rot. Bonds4

About 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide

1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide (PubChem CID 138583497) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide.

Molecular Properties

Compound Name1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide
PubChem CID138583497
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide
SMILESCC(C)NS(=O)(=O)C1(CO)CC1
InChIInChI=1S/C7H15NO3S/c1-6(2)8-12(10,11)7(5-9)3-4-7/h6,8-9H,3-5H2,1-2H3
InChIKeyQMFZRPGDTWXBFO-UHFFFAOYSA-N
XLogP-0.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide?
The IUPAC name of 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide (CID 138583497) is 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide.
What is the SMILES notation for 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide?
The canonical SMILES for 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide is CC(C)NS(=O)(=O)C1(CO)CC1.
What is the InChIKey of 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide?
The InChIKey is QMFZRPGDTWXBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-6(2)8-12(10,11)7(5-9)3-4-7/h6,8-9H,3-5H2,1-2H3.
What are the key properties of 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide?
1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide has a molecular weight of 193.27 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-N-propan-2-ylcyclopropane-1-sulfonamide is sourced from PubChem (CID 138583497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).