2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide

C10H11BrN4O — CID 69414030

IUPAC2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide
SMILESNC(=O)CN1Cc2cc(Br)ccc2N=C1N
InChIInChI=1S/C10H11BrN4O/c11-7-1-2-8-6(3-7)4-15(5-9(12)16)10(13)14-8/h1-3H,4-5H2,(H2,12,16)(H2,13,14)
InChIKeyQFEWGFCGAZNJJW-UHFFFAOYSA-N
MW283.13 g/mol
LogP0.70
Rot. Bonds2

About 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide

2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide (PubChem CID 69414030) has the molecular formula C10H11BrN4O and a molecular weight of 283.13 g/mol. Its IUPAC name is 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide
PubChem CID69414030
Molecular FormulaC10H11BrN4O
Molecular Weight283.13 g/mol
Exact Mass282.01
IUPAC Name2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide
SMILESNC(=O)CN1Cc2cc(Br)ccc2N=C1N
InChIInChI=1S/C10H11BrN4O/c11-7-1-2-8-6(3-7)4-15(5-9(12)16)10(13)14-8/h1-3H,4-5H2,(H2,12,16)(H2,13,14)
InChIKeyQFEWGFCGAZNJJW-UHFFFAOYSA-N
XLogP0.70
TPSA84.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.13
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide?
The IUPAC name of 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide (CID 69414030) is 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide.
What is the SMILES notation for 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide?
The canonical SMILES for 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide is NC(=O)CN1Cc2cc(Br)ccc2N=C1N.
What is the InChIKey of 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide?
The InChIKey is QFEWGFCGAZNJJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4O/c11-7-1-2-8-6(3-7)4-15(5-9(12)16)10(13)14-8/h1-3H,4-5H2,(H2,12,16)(H2,13,14).
What are the key properties of 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide?
2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide has a molecular weight of 283.13 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-6-bromo-4H-quinazolin-3-yl)acetamide is sourced from PubChem (CID 69414030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).