(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid

C10H12N4O3 — CID 97169281

IUPAC(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid
SMILESO=C(O)[C@H]1CN(C(=O)c2cnccn2)CCN1
InChIInChI=1S/C10H12N4O3/c15-9(7-5-11-1-2-12-7)14-4-3-13-8(6-14)10(16)17/h1-2,5,8,13H,3-4,6H2,(H,16,17)/t8-/m1/s1
InChIKeyHKSQEYQAXSOZAG-MRVPVSSYSA-N
MW236.23 g/mol
LogP-1.02
Rot. Bonds2

About (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid

(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid (PubChem CID 97169281) has the molecular formula C10H12N4O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid
PubChem CID97169281
Molecular FormulaC10H12N4O3
Molecular Weight236.23 g/mol
Exact Mass236.09
IUPAC Name(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid
SMILESO=C(O)[C@H]1CN(C(=O)c2cnccn2)CCN1
InChIInChI=1S/C10H12N4O3/c15-9(7-5-11-1-2-12-7)14-4-3-13-8(6-14)10(16)17/h1-2,5,8,13H,3-4,6H2,(H,16,17)/t8-/m1/s1
InChIKeyHKSQEYQAXSOZAG-MRVPVSSYSA-N
XLogP-1.02
TPSA95.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(pyrazine-2-carbonyl)piperidine-3-carboxylic acid
CID 16776959
(3-aminopyrrolidin-1-yl)-pyrazin-2-ylmethanone;hydrochloride
CID 71644274
1,3,4,6,7,8,9,9a-octahydropyrazino[1,2-a]pyrazin-2-yl(pyrazin-2-yl)methanone
CID 141072428
[4-(pyrazine-2-carbonyl)piperazin-1-yl]-(1,3-thiazolidin-4-yl)methanone
CID 110814149
1-(pyrazine-2-carbonyl)-1,4-diazepan-5-one
CID 62046605
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 115746589
[4-(azetidin-3-yl)piperazin-1-yl]-pyrazin-2-ylmethanone
CID 66203494
pyrazin-2-yl-[(3R)-3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone
CID 95841608
(3S)-piperazine-1,3-dicarboxylic acid
CID 68637111
[(3R)-3-(methylamino)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 94475780
4-(4-methyl-1H-pyrrole-2-carbonyl)piperazine-2-carboxylic acid
CID 56880977
[(3S)-3-(cyclopropylmethoxy)pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 129492855

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid?
The IUPAC name of (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid (CID 97169281) is (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid.
What is the SMILES notation for (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid?
The canonical SMILES for (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid is O=C(O)[C@H]1CN(C(=O)c2cnccn2)CCN1.
What is the InChIKey of (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid?
The InChIKey is HKSQEYQAXSOZAG-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H12N4O3/c15-9(7-5-11-1-2-12-7)14-4-3-13-8(6-14)10(16)17/h1-2,5,8,13H,3-4,6H2,(H,16,17)/t8-/m1/s1.
What are the key properties of (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid?
(2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid has a molecular weight of 236.23 g/mol, XLogP of -1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(pyrazine-2-carbonyl)piperazine-2-carboxylic acid is sourced from PubChem (CID 97169281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).