N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide

C23H25N5O2 — CID 110238786

About N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide

N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide (PubChem CID 110238786) has the molecular formula C23H25N5O2 and a molecular weight of 403.49 g/mol. Its IUPAC name is N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide.

Molecular Properties

• Compound Name: N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide
• PubChem CID: 110238786
• Molecular Formula: C23H25N5O2
• Molecular Weight: 403.49 g/mol
• Exact Mass: 403.20
• IUPAC Name: N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide
• SMILES: COCc1ccc(C(=O)NC2CC(C)(C)Cc3nc(-c4cnccn4)ncc32)cc1
• InChI: InChI=1S/C23H25N5O2/c1-23(2)10-18-17(12-26-21(27-18)20-13-24-8-9-25-20)19(11-23)28-22(29)16-6-4-15(5-7-16)14-30-3/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,28,29)
• InChIKey: POJINYMTGDZOEN-UHFFFAOYSA-N
• XLogP: 3.52
• TPSA: 89.89 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	403.49
LogP ≤ 5	3.52
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide?

The IUPAC name of N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide (CID 110238786) is N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide.

What is the SMILES notation for N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide?

The canonical SMILES for N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide is COCc1ccc(C(=O)NC2CC(C)(C)Cc3nc(-c4cnccn4)ncc32)cc1.

What is the InChIKey of N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide?

The InChIKey is POJINYMTGDZOEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O2/c1-23(2)10-18-17(12-26-21(27-18)20-13-24-8-9-25-20)19(11-23)28-22(29)16-6-4-15(5-7-16)14-30-3/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,28,29).

What are the key properties of N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide?

N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide has a molecular weight of 403.49 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(methoxymethyl)benzamide is sourced from PubChem (CID 110238786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).