4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid

C9H13N5O2 — CID 141367991

IUPAC4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid
SMILESNc1cnc(N2CCN(C(=O)O)CC2)cn1
InChIInChI=1S/C9H13N5O2/c10-7-5-12-8(6-11-7)13-1-3-14(4-2-13)9(15)16/h5-6H,1-4H2,(H2,10,11)(H,15,16)
InChIKeyUQNYSVULSCBMJZ-UHFFFAOYSA-N
MW223.24 g/mol
LogP-0.14
Rot. Bonds1

About 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid

4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid (PubChem CID 141367991) has the molecular formula C9H13N5O2 and a molecular weight of 223.24 g/mol. Its IUPAC name is 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid.

Molecular Properties

Compound Name4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid
PubChem CID141367991
Molecular FormulaC9H13N5O2
Molecular Weight223.24 g/mol
Exact Mass223.11
IUPAC Name4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid
SMILESNc1cnc(N2CCN(C(=O)O)CC2)cn1
InChIInChI=1S/C9H13N5O2/c10-7-5-12-8(6-11-7)13-1-3-14(4-2-13)9(15)16/h5-6H,1-4H2,(H2,10,11)(H,15,16)
InChIKeyUQNYSVULSCBMJZ-UHFFFAOYSA-N
XLogP-0.14
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;5-piperidin-1-ylpyrazin-2-amine
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4-(5-phenyl-2-pyridinyl)piperazine-1-carboxylic acid
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4-(6-aminopyridine-3-carbonyl)piperazine-1-carboxylic acid
CID 86641079
5-[4-(2-chlorophenyl)piperazin-1-yl]pyrazin-2-amine
CID 80653011
4-(2-amino-6-chloropyrimidin-4-yl)piperazine-1-carboxylic acid
CID 118063077
5-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]pyrazine-2-carboxylic acid
CID 122047688
4-(4-amino-5-bromopyrimidin-2-yl)piperazine-1-carboxylic acid
CID 67394845
5-[4-(4-methoxyphenyl)piperazin-1-yl]pyrazin-2-amine
CID 80651957
5-(4-tert-butylpiperidin-1-yl)pyrazin-2-amine
CID 80652911
4-[5-(4-acetamido-3-aminophenyl)-2-pyridinyl]piperazine-1-carboxylic acid
CID 118108439
4-(5-amino-6-chloroquinolin-2-yl)piperazine-1-carboxylic acid
CID 69322377

Frequently Asked Questions

What is the IUPAC name of 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid?
The IUPAC name of 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid (CID 141367991) is 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid.
What is the SMILES notation for 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid?
The canonical SMILES for 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid is Nc1cnc(N2CCN(C(=O)O)CC2)cn1.
What is the InChIKey of 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid?
The InChIKey is UQNYSVULSCBMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O2/c10-7-5-12-8(6-11-7)13-1-3-14(4-2-13)9(15)16/h5-6H,1-4H2,(H2,10,11)(H,15,16).
What are the key properties of 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid?
4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid has a molecular weight of 223.24 g/mol, XLogP of -0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-aminopyrazin-2-yl)piperazine-1-carboxylic acid is sourced from PubChem (CID 141367991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).