2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide

C8H12N4O2 — CID 66327451

IUPAC2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide
SMILESCOc1ncnc(NCC(N)=O)c1C
InChIInChI=1S/C8H12N4O2/c1-5-7(10-3-6(9)13)11-4-12-8(5)14-2/h4H,3H2,1-2H3,(H2,9,13)(H,10,11,12)
InChIKeyHFMHMDZRFCWYFN-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.31
Rot. Bonds4

About 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide

2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide (PubChem CID 66327451) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide
PubChem CID66327451
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide
SMILESCOc1ncnc(NCC(N)=O)c1C
InChIInChI=1S/C8H12N4O2/c1-5-7(10-3-6(9)13)11-4-12-8(5)14-2/h4H,3H2,1-2H3,(H2,9,13)(H,10,11,12)
InChIKeyHFMHMDZRFCWYFN-UHFFFAOYSA-N
XLogP-0.31
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide?
The IUPAC name of 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide (CID 66327451) is 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide?
The canonical SMILES for 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide is COc1ncnc(NCC(N)=O)c1C.
What is the InChIKey of 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide?
The InChIKey is HFMHMDZRFCWYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-5-7(10-3-6(9)13)11-4-12-8(5)14-2/h4H,3H2,1-2H3,(H2,9,13)(H,10,11,12).
What are the key properties of 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide?
2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide has a molecular weight of 196.21 g/mol, XLogP of -0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 66327451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).