N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide

C10H16N2O3S — CID 71785599

IUPACN-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide
SMILESO=C(NC1CC1)C1CN(S(=O)(=O)C2CC2)C1
InChIInChI=1S/C10H16N2O3S/c13-10(11-8-1-2-8)7-5-12(6-7)16(14,15)9-3-4-9/h7-9H,1-6H2,(H,11,13)
InChIKeyDGUFHWWSZWADAO-UHFFFAOYSA-N
MW244.32 g/mol
LogP-0.31
Rot. Bonds4

About N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide

N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide (PubChem CID 71785599) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide
PubChem CID71785599
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide
SMILESO=C(NC1CC1)C1CN(S(=O)(=O)C2CC2)C1
InChIInChI=1S/C10H16N2O3S/c13-10(11-8-1-2-8)7-5-12(6-7)16(14,15)9-3-4-9/h7-9H,1-6H2,(H,11,13)
InChIKeyDGUFHWWSZWADAO-UHFFFAOYSA-N
XLogP-0.31
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide (CID 71785599) is N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide is O=C(NC1CC1)C1CN(S(=O)(=O)C2CC2)C1.
What is the InChIKey of N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide?
The InChIKey is DGUFHWWSZWADAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c13-10(11-8-1-2-8)7-5-12(6-7)16(14,15)9-3-4-9/h7-9H,1-6H2,(H,11,13).
What are the key properties of N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide?
N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide has a molecular weight of 244.32 g/mol, XLogP of -0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-cyclopropylsulfonylazetidine-3-carboxamide is sourced from PubChem (CID 71785599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).