1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide

C10H14N4O4S — CID 65427807

IUPAC1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide
SMILESNC(=O)C1CC(O)CN1S(=O)(=O)c1cccnc1N
InChIInChI=1S/C10H14N4O4S/c11-9-8(2-1-3-13-9)19(17,18)14-5-6(15)4-7(14)10(12)16/h1-3,6-7,15H,4-5H2,(H2,11,13)(H2,12,16)
InChIKeyIXPVLBVRGZKODE-UHFFFAOYSA-N
MW286.31 g/mol
LogP-1.73
Rot. Bonds3

About 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide

1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 65427807) has the molecular formula C10H14N4O4S and a molecular weight of 286.31 g/mol. Its IUPAC name is 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide
PubChem CID65427807
Molecular FormulaC10H14N4O4S
Molecular Weight286.31 g/mol
Exact Mass286.07
IUPAC Name1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide
SMILESNC(=O)C1CC(O)CN1S(=O)(=O)c1cccnc1N
InChIInChI=1S/C10H14N4O4S/c11-9-8(2-1-3-13-9)19(17,18)14-5-6(15)4-7(14)10(12)16/h1-3,6-7,15H,4-5H2,(H2,11,13)(H2,12,16)
InChIKeyIXPVLBVRGZKODE-UHFFFAOYSA-N
XLogP-1.73
TPSA139.61 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 5-1.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide (CID 65427807) is 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide is NC(=O)C1CC(O)CN1S(=O)(=O)c1cccnc1N.
What is the InChIKey of 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is IXPVLBVRGZKODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O4S/c11-9-8(2-1-3-13-9)19(17,18)14-5-6(15)4-7(14)10(12)16/h1-3,6-7,15H,4-5H2,(H2,11,13)(H2,12,16).
What are the key properties of 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide?
1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 286.31 g/mol, XLogP of -1.73, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-amino-3-pyridinyl)sulfonyl]-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 65427807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).