5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide

C10H14N4O4S — CID 175779192

IUPAC5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide
SMILESCNS(=O)(=O)NC(=O)CCc1ccc(C(N)=O)nc1
InChIInChI=1S/C10H14N4O4S/c1-12-19(17,18)14-9(15)5-3-7-2-4-8(10(11)16)13-6-7/h2,4,6,12H,3,5H2,1H3,(H2,11,16)(H,14,15)
InChIKeyZXCQVGLPWXYMFD-UHFFFAOYSA-N
MW286.31 g/mol
LogP-1.31
Rot. Bonds6

About 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide

5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide (PubChem CID 175779192) has the molecular formula C10H14N4O4S and a molecular weight of 286.31 g/mol. Its IUPAC name is 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide
PubChem CID175779192
Molecular FormulaC10H14N4O4S
Molecular Weight286.31 g/mol
Exact Mass286.07
IUPAC Name5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide
SMILESCNS(=O)(=O)NC(=O)CCc1ccc(C(N)=O)nc1
InChIInChI=1S/C10H14N4O4S/c1-12-19(17,18)14-9(15)5-3-7-2-4-8(10(11)16)13-6-7/h2,4,6,12H,3,5H2,1H3,(H2,11,16)(H,14,15)
InChIKeyZXCQVGLPWXYMFD-UHFFFAOYSA-N
XLogP-1.31
TPSA131.25 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 5-1.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide?
The IUPAC name of 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide (CID 175779192) is 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide?
The canonical SMILES for 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide is CNS(=O)(=O)NC(=O)CCc1ccc(C(N)=O)nc1.
What is the InChIKey of 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide?
The InChIKey is ZXCQVGLPWXYMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O4S/c1-12-19(17,18)14-9(15)5-3-7-2-4-8(10(11)16)13-6-7/h2,4,6,12H,3,5H2,1H3,(H2,11,16)(H,14,15).
What are the key properties of 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide?
5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide has a molecular weight of 286.31 g/mol, XLogP of -1.31, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(methylsulfamoylamino)-3-oxopropyl]pyridine-2-carboxamide is sourced from PubChem (CID 175779192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).