2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline

C16H15N3 — CID 10083413

IUPAC2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline
SMILESCc1ccc2c(c1)CN1Cc3ccccc3NC1=N2
InChIInChI=1S/C16H15N3/c1-11-6-7-15-13(8-11)10-19-9-12-4-2-3-5-14(12)17-16(19)18-15/h2-8H,9-10H2,1H3,(H,17,18)
InChIKeyDMARZXXLQVZXMT-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.42
Rot. Bonds

About 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline

2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline (PubChem CID 10083413) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline.

Molecular Properties

Compound Name2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline
PubChem CID10083413
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline
SMILESCc1ccc2c(c1)CN1Cc3ccccc3NC1=N2
InChIInChI=1S/C16H15N3/c1-11-6-7-15-13(8-11)10-19-9-12-4-2-3-5-14(12)17-16(19)18-15/h2-8H,9-10H2,1H3,(H,17,18)
InChIKeyDMARZXXLQVZXMT-UHFFFAOYSA-N
XLogP3.42
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline?
The IUPAC name of 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline (CID 10083413) is 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline.
What is the SMILES notation for 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline?
The canonical SMILES for 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline is Cc1ccc2c(c1)CN1Cc3ccccc3NC1=N2.
What is the InChIKey of 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline?
The InChIKey is DMARZXXLQVZXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-11-6-7-15-13(8-11)10-19-9-12-4-2-3-5-14(12)17-16(19)18-15/h2-8H,9-10H2,1H3,(H,17,18).
What are the key properties of 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline?
2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline has a molecular weight of 249.32 g/mol, XLogP of 3.42, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline is sourced from PubChem (CID 10083413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).