2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide

C10H16N4O2 — CID 81088885

IUPAC2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide
SMILESCOCC(N)C(=O)NCc1cnc(C)cn1
InChIInChI=1S/C10H16N4O2/c1-7-3-13-8(4-12-7)5-14-10(15)9(11)6-16-2/h3-4,9H,5-6,11H2,1-2H3,(H,14,15)
InChIKeyBMNPZKFZIJPCOW-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.63
Rot. Bonds5

About 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide

2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide (PubChem CID 81088885) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide
PubChem CID81088885
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide
SMILESCOCC(N)C(=O)NCc1cnc(C)cn1
InChIInChI=1S/C10H16N4O2/c1-7-3-13-8(4-12-7)5-14-10(15)9(11)6-16-2/h3-4,9H,5-6,11H2,1-2H3,(H,14,15)
InChIKeyBMNPZKFZIJPCOW-UHFFFAOYSA-N
XLogP-0.63
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide?
The IUPAC name of 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide (CID 81088885) is 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide is COCC(N)C(=O)NCc1cnc(C)cn1.
What is the InChIKey of 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide?
The InChIKey is BMNPZKFZIJPCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-7-3-13-8(4-12-7)5-14-10(15)9(11)6-16-2/h3-4,9H,5-6,11H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide?
2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide has a molecular weight of 224.26 g/mol, XLogP of -0.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propanamide is sourced from PubChem (CID 81088885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).