4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid

C10H13N3O3 — CID 83064675

IUPAC4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid
SMILESCc1nccnc1N1CCOCC1C(=O)O
InChIInChI=1S/C10H13N3O3/c1-7-9(12-3-2-11-7)13-4-5-16-6-8(13)10(14)15/h2-3,8H,4-6H2,1H3,(H,14,15)
InChIKeyYSRFUDRGKBSQQD-UHFFFAOYSA-N
MW223.23 g/mol
LogP0.07
Rot. Bonds2

About 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid

4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid (PubChem CID 83064675) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid.

Molecular Properties

Compound Name4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid
PubChem CID83064675
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid
SMILESCc1nccnc1N1CCOCC1C(=O)O
InChIInChI=1S/C10H13N3O3/c1-7-9(12-3-2-11-7)13-4-5-16-6-8(13)10(14)15/h2-3,8H,4-6H2,1H3,(H,14,15)
InChIKeyYSRFUDRGKBSQQD-UHFFFAOYSA-N
XLogP0.07
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylate
CID 104775194
4-(5-amino-6-oxo-1H-pyrimidin-4-yl)morpholine-3-carboxylic acid
CID 136959131
4-(4-methoxycarbonyl-2-pyridinyl)morpholine-3-carboxylic acid
CID 114074932
methyl 4-(3-chloro-2-pyridinyl)morpholine-3-carboxylate
CID 104775121
4-(4-cyanopyrimidin-2-yl)morpholine-3-carboxylic acid
CID 107543044
methyl 4-(3-bromo-2-pyridinyl)morpholine-3-carboxylate
CID 104775122
4-(3-cyano-4-methyl-2-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83099052
4-(3-amino-5-methyl-2-pyridinyl)morpholine-3-carboxamide
CID 83101058
(3R)-4-methylmorpholine-3-carboxylic acid
CID 66864905
N-[[1-(3-methylpyrazin-2-yl)piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 131950838
2-[3-(2-methoxyethyl)morpholin-4-yl]-4-methylpyridine-3-carboxylic acid
CID 70816687
4-(6-methoxycarbonylpyrazin-2-yl)morpholine-3-carboxylic acid
CID 66455443

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid?
The IUPAC name of 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid (CID 83064675) is 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid.
What is the SMILES notation for 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid?
The canonical SMILES for 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid is Cc1nccnc1N1CCOCC1C(=O)O.
What is the InChIKey of 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid?
The InChIKey is YSRFUDRGKBSQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-7-9(12-3-2-11-7)13-4-5-16-6-8(13)10(14)15/h2-3,8H,4-6H2,1H3,(H,14,15).
What are the key properties of 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid?
4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid has a molecular weight of 223.23 g/mol, XLogP of 0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylpyrazin-2-yl)morpholine-3-carboxylic acid is sourced from PubChem (CID 83064675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).