N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide

C16H16FN3O4S — CID 52871230

IUPACN-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1ccc(F)cn1)c1ccccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H16FN3O4S/c17-12-5-6-15(18-11-12)19-16(21)13-3-1-2-4-14(13)25(22,23)20-7-9-24-10-8-20/h1-6,11H,7-10H2,(H,18,19,21)
InChIKeyRXQUOIBRHDLQTB-UHFFFAOYSA-N
MW365.39 g/mol
LogP1.49
Rot. Bonds4

About N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide

N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide (PubChem CID 52871230) has the molecular formula C16H16FN3O4S and a molecular weight of 365.39 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide
PubChem CID52871230
Molecular FormulaC16H16FN3O4S
Molecular Weight365.39 g/mol
Exact Mass365.08
IUPAC NameN-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1ccc(F)cn1)c1ccccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H16FN3O4S/c17-12-5-6-15(18-11-12)19-16(21)13-3-1-2-4-14(13)25(22,23)20-7-9-24-10-8-20/h1-6,11H,7-10H2,(H,18,19,21)
InChIKeyRXQUOIBRHDLQTB-UHFFFAOYSA-N
XLogP1.49
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-morpholin-4-ylsulfonylbenzohydrazide
CID 71258107
N-(4-iodophenyl)-2-morpholin-4-ylsulfonylbenzamide
CID 39892592
N-(2-methylphenyl)-2-morpholin-4-ylsulfonylbenzamide
CID 55623858
2-fluoro-N-(2-morpholin-4-ylsulfonylphenyl)benzamide
CID 90451563
N-(4-tert-butylphenyl)-2-morpholin-4-ylsulfonylbenzamide
CID 39888559
methyl 4-[(2-morpholin-4-ylsulfonylbenzoyl)amino]benzoate
CID 39888374
2-piperidin-1-ylsulfonyl-N-pyrazin-2-ylbenzamide
CID 131960359
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-fluorobenzamide
CID 3363569
2-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 31972800
2-chloro-5-morpholin-4-ylsulfonyl-N-(5-phenyl-2-pyridinyl)benzamide
CID 55978562
N-[4-(2-methoxyphenoxy)phenyl]-2-morpholin-4-ylsulfonylbenzamide
CID 31976551
N'-(4-bromobenzoyl)-2-morpholin-4-ylsulfonylbenzohydrazide
CID 39878344

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide (CID 52871230) is N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide is O=C(Nc1ccc(F)cn1)c1ccccc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide?
The InChIKey is RXQUOIBRHDLQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O4S/c17-12-5-6-15(18-11-12)19-16(21)13-3-1-2-4-14(13)25(22,23)20-7-9-24-10-8-20/h1-6,11H,7-10H2,(H,18,19,21).
What are the key properties of N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide?
N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide has a molecular weight of 365.39 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-2-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 52871230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).