N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide

C13H14N2O2S2 — CID 121166356

IUPACN-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCc1cccnc1-c1cccs1)C1CC1
InChIInChI=1S/C13H14N2O2S2/c16-19(17,11-5-6-11)15-9-10-3-1-7-14-13(10)12-4-2-8-18-12/h1-4,7-8,11,15H,5-6,9H2
InChIKeyFKCIOQVFAIDPJS-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.39
Rot. Bonds5

About N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide

N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide (PubChem CID 121166356) has the molecular formula C13H14N2O2S2 and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide
PubChem CID121166356
Molecular FormulaC13H14N2O2S2
Molecular Weight294.40 g/mol
Exact Mass294.05
IUPAC NameN-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCc1cccnc1-c1cccs1)C1CC1
InChIInChI=1S/C13H14N2O2S2/c16-19(17,11-5-6-11)15-9-10-3-1-7-14-13(10)12-4-2-8-18-12/h1-4,7-8,11,15H,5-6,9H2
InChIKeyFKCIOQVFAIDPJS-UHFFFAOYSA-N
XLogP2.39
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclohexanesulfonamide
CID 121166361
N-[(2-thiophen-2-yl-3-pyridinyl)methyl]ethanesulfonamide
CID 121166355
3,3,3-trifluoro-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]propane-1-sulfonamide
CID 91625886
2-bromo-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 91625864
2,4,6-trimethyl-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 121166387
(E)-2-phenyl-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]ethenesulfonamide
CID 121166367
1-cyclopentyl-3-[(2-thiophen-2-yl-3-pyridinyl)methyl]urea
CID 121166342
3-phenoxy-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]propane-1-sulfonamide
CID 91625872
1-methyl-2-propan-2-yl-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]imidazole-4-sulfonamide
CID 91625884
(2R)-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]oxolane-2-carboxamide
CID 100745825
(3S)-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]oxolane-3-carboxamide
CID 100746069
5-fluoro-2-methoxy-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 121166393

Frequently Asked Questions

What is the IUPAC name of N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide?
The IUPAC name of N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide (CID 121166356) is N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide?
The canonical SMILES for N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide is O=S(=O)(NCc1cccnc1-c1cccs1)C1CC1.
What is the InChIKey of N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide?
The InChIKey is FKCIOQVFAIDPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S2/c16-19(17,11-5-6-11)15-9-10-3-1-7-14-13(10)12-4-2-8-18-12/h1-4,7-8,11,15H,5-6,9H2.
What are the key properties of N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide?
N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide has a molecular weight of 294.40 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-thiophen-2-yl-3-pyridinyl)methyl]cyclopropanesulfonamide is sourced from PubChem (CID 121166356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).