pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid

C10H14N4O3 — CID 161267101

IUPACpyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid
SMILESNC(=O)c1cccnn1.O=C(O)C1CCCN1
InChIInChI=1S/C5H5N3O.C5H9NO2/c6-5(9)4-2-1-3-7-8-4;7-5(8)4-2-1-3-6-4/h1-3H,(H2,6,9);4,6H,1-3H2,(H,7,8)
InChIKeyVDIFMDFYHBVVFK-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.60
Rot. Bonds2

About pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid

pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid (PubChem CID 161267101) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Namepyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid
PubChem CID161267101
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Namepyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid
SMILESNC(=O)c1cccnn1.O=C(O)C1CCCN1
InChIInChI=1S/C5H5N3O.C5H9NO2/c6-5(9)4-2-1-3-7-8-4;7-5(8)4-2-1-3-6-4/h1-3H,(H2,6,9);4,6H,1-3H2,(H,7,8)
InChIKeyVDIFMDFYHBVVFK-UHFFFAOYSA-N
XLogP-0.60
TPSA118.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-pyrrolidine-2-carboxylic acid;urea
CID 11629677
pyrrolidine-2-carboxylic acid;yttrium
CID 21344974
bicyclo[2.2.0]hexa-1,3,5-triene;pyrrolidine-2-carboxylic acid
CID 70124841
sodium;pyrrolidine-2-carboxylic acid;chloride
CID 68997199
calcium;(2S)-pyrrolidine-2-carboxylic acid;dichloride
CID 174944173
hydrogen peroxide;(2S)-pyrrolidine-2-carboxylic acid
CID 158114560
pyrrolidine-2-carboxylic acid
CID 614
(213C)azolidine-2-carboxylic acid
CID 10290769
argon;(2S)-pyrrolidine-2-carboxylic acid
CID 160825816
(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide
CID 104901521
potassium (2R)-pyrrolidine-2-carboxylic acid
CID 177481174
bis((2S)-pyrrolidine-2-carboxylic acid);hydrate
CID 67110713

Frequently Asked Questions

What is the IUPAC name of pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid?
The IUPAC name of pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid (CID 161267101) is pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid.
What is the SMILES notation for pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid?
The canonical SMILES for pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid is NC(=O)c1cccnn1.O=C(O)C1CCCN1.
What is the InChIKey of pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid?
The InChIKey is VDIFMDFYHBVVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N3O.C5H9NO2/c6-5(9)4-2-1-3-7-8-4;7-5(8)4-2-1-3-6-4/h1-3H,(H2,6,9);4,6H,1-3H2,(H,7,8).
What are the key properties of pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid?
pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid has a molecular weight of 238.25 g/mol, XLogP of -0.60, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 161267101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).