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

C18H23N5O — CID 110238760

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

N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide (PubChem CID 110238760) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide.

Molecular Properties

• Compound Name: N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide
• PubChem CID: 110238760
• Molecular Formula: C18H23N5O
• Molecular Weight: 325.42 g/mol
• Exact Mass: 325.19
• IUPAC Name: N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide
• SMILES: CCCC(=O)NC1CC(C)(C)Cc2nc(-c3cnccn3)ncc21
• InChI: InChI=1S/C18H23N5O/c1-4-5-16(24)22-13-8-18(2,3)9-14-12(13)10-21-17(23-14)15-11-19-6-7-20-15/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,22,24)
• InChIKey: GGEBIRDRIULFHP-UHFFFAOYSA-N
• XLogP: 2.86
• TPSA: 80.66 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	325.42
LogP ≤ 5	2.86
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide (CID 110238760) is N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide.

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

The canonical SMILES for N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide is CCCC(=O)NC1CC(C)(C)Cc2nc(-c3cnccn3)ncc21.

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

The InChIKey is GGEBIRDRIULFHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O/c1-4-5-16(24)22-13-8-18(2,3)9-14-12(13)10-21-17(23-14)15-11-19-6-7-20-15/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,22,24).

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

N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)butanamide has a molecular weight of 325.42 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 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)butanamide is sourced from PubChem (CID 110238760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).