3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine

C12H15FN2O4S — CID 166419597

IUPAC3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine
SMILESCC1CCCC1C(=O)Nc1cncc(OS(=O)(=O)F)c1
InChIInChI=1S/C12H15FN2O4S/c1-8-3-2-4-11(8)12(16)15-9-5-10(7-14-6-9)19-20(13,17)18/h5-8,11H,2-4H2,1H3,(H,15,16)
InChIKeyCZNSWGSLSNUPRS-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.05
Rot. Bonds4

About 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine

3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine (PubChem CID 166419597) has the molecular formula C12H15FN2O4S and a molecular weight of 302.33 g/mol. Its IUPAC name is 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine.

Molecular Properties

Compound Name3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine
PubChem CID166419597
Molecular FormulaC12H15FN2O4S
Molecular Weight302.33 g/mol
Exact Mass302.07
IUPAC Name3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine
SMILESCC1CCCC1C(=O)Nc1cncc(OS(=O)(=O)F)c1
InChIInChI=1S/C12H15FN2O4S/c1-8-3-2-4-11(8)12(16)15-9-5-10(7-14-6-9)19-20(13,17)18/h5-8,11H,2-4H2,1H3,(H,15,16)
InChIKeyCZNSWGSLSNUPRS-UHFFFAOYSA-N
XLogP2.05
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluorosulfonyloxy-5-(oxane-2-carbonylamino)pyridine
CID 154880909
3-fluorosulfonyloxy-5-[[2-(oxan-3-yl)acetyl]amino]pyridine
CID 154873144
3-fluorosulfonyloxy-5-[[1-(triazol-2-yl)cyclopropanecarbonyl]amino]pyridine
CID 154873154
N-(6-chloropyrazin-2-yl)-2-methylcyclopentane-1-carboxamide
CID 104938117
2-bromo-4-[(2-methylcyclopentanecarbonyl)amino]benzenesulfonyl chloride
CID 107176182
N-(4-methoxyphenyl)-2-methylcyclohexane-1-carboxamide
CID 4262812
1-[(2-cyclopropylcyclohexanecarbonyl)amino]-4-fluorosulfonyloxybenzene
CID 166417194
N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
CID 107182876
(5-ethoxy-3-pyridinyl)-(2-methylcyclopentyl)methanone
CID 107187365
2-[4-[(2-methylcyclopentanecarbonyl)amino]phenoxy]acetic acid
CID 107175510
2-(aminomethyl)-N-(5-fluoro-3-pyridinyl)cyclopentane-1-carboxamide
CID 114254668
3-[di(propan-2-yl)carbamoyl]-5-fluorosulfonyloxypyridine
CID 154881437

Frequently Asked Questions

What is the IUPAC name of 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine?
The IUPAC name of 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine (CID 166419597) is 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine.
What is the SMILES notation for 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine?
The canonical SMILES for 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine is CC1CCCC1C(=O)Nc1cncc(OS(=O)(=O)F)c1.
What is the InChIKey of 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine?
The InChIKey is CZNSWGSLSNUPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O4S/c1-8-3-2-4-11(8)12(16)15-9-5-10(7-14-6-9)19-20(13,17)18/h5-8,11H,2-4H2,1H3,(H,15,16).
What are the key properties of 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine?
3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine has a molecular weight of 302.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluorosulfonyloxy-5-[(2-methylcyclopentanecarbonyl)amino]pyridine is sourced from PubChem (CID 166419597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).