N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide

C15H20N2O3S — CID 833152

IUPACN-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC1
InChIInChI=1S/C15H20N2O3S/c18-15(12-4-5-12)16-13-6-8-14(9-7-13)21(19,20)17-10-2-1-3-11-17/h6-9,12H,1-5,10-11H2,(H,16,18)
InChIKeyMWFAQNDHELOASW-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.21
Rot. Bonds4

About N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide

N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide (PubChem CID 833152) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide
PubChem CID833152
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC1
InChIInChI=1S/C15H20N2O3S/c18-15(12-4-5-12)16-13-6-8-14(9-7-13)21(19,20)17-10-2-1-3-11-17/h6-9,12H,1-5,10-11H2,(H,16,18)
InChIKeyMWFAQNDHELOASW-UHFFFAOYSA-N
XLogP2.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide?
The IUPAC name of N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide (CID 833152) is N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide?
The canonical SMILES for N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide is O=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC1.
What is the InChIKey of N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide?
The InChIKey is MWFAQNDHELOASW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c18-15(12-4-5-12)16-13-6-8-14(9-7-13)21(19,20)17-10-2-1-3-11-17/h6-9,12H,1-5,10-11H2,(H,16,18).
What are the key properties of N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide?
N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide has a molecular weight of 308.40 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperidin-1-ylsulfonylphenyl)cyclopropanecarboxamide is sourced from PubChem (CID 833152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).