9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline

C18H16N4 — CID 166921426

IUPAC9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline
SMILESCc1cnc(-c2c(C)ccc3cn4ccnc4nc23)cc1C
InChIInChI=1S/C18H16N4/c1-11-4-5-14-10-22-7-6-19-18(22)21-17(14)16(11)15-8-12(2)13(3)9-20-15/h4-10H,1-3H3
InChIKeyVUFHLUWFDZHXOQ-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.87
Rot. Bonds1

About 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline

9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline (PubChem CID 166921426) has the molecular formula C18H16N4 and a molecular weight of 288.35 g/mol. Its IUPAC name is 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline.

Molecular Properties

Compound Name9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline
PubChem CID166921426
Molecular FormulaC18H16N4
Molecular Weight288.35 g/mol
Exact Mass288.14
IUPAC Name9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline
SMILESCc1cnc(-c2c(C)ccc3cn4ccnc4nc23)cc1C
InChIInChI=1S/C18H16N4/c1-11-4-5-14-10-22-7-6-19-18(22)21-17(14)16(11)15-8-12(2)13(3)9-20-15/h4-10H,1-3H3
InChIKeyVUFHLUWFDZHXOQ-UHFFFAOYSA-N
XLogP3.87
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline?
The IUPAC name of 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline (CID 166921426) is 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline.
What is the SMILES notation for 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline?
The canonical SMILES for 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline is Cc1cnc(-c2c(C)ccc3cn4ccnc4nc23)cc1C.
What is the InChIKey of 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline?
The InChIKey is VUFHLUWFDZHXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4/c1-11-4-5-14-10-22-7-6-19-18(22)21-17(14)16(11)15-8-12(2)13(3)9-20-15/h4-10H,1-3H3.
What are the key properties of 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline?
9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline has a molecular weight of 288.35 g/mol, XLogP of 3.87, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4,5-dimethyl-2-pyridinyl)-8-methylimidazo[2,1-b]quinazoline is sourced from PubChem (CID 166921426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).