2-(1H-indol-2-yl)quinazoline

C16H11N3 — CID 68890263

IUPAC2-(1H-indol-2-yl)quinazoline
SMILESc1ccc2nc(-c3cc4ccccc4[nH]3)ncc2c1
InChIInChI=1S/C16H11N3/c1-3-7-13-11(5-1)9-15(18-13)16-17-10-12-6-2-4-8-14(12)19-16/h1-10,18H
InChIKeyBKDUDQVZJQBTJF-UHFFFAOYSA-N
MW245.28 g/mol
LogP3.78
Rot. Bonds1

About 2-(1H-indol-2-yl)quinazoline

2-(1H-indol-2-yl)quinazoline (PubChem CID 68890263) has the molecular formula C16H11N3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(1H-indol-2-yl)quinazoline.

Molecular Properties

Compound Name2-(1H-indol-2-yl)quinazoline
PubChem CID68890263
Molecular FormulaC16H11N3
Molecular Weight245.28 g/mol
Exact Mass245.10
IUPAC Name2-(1H-indol-2-yl)quinazoline
SMILESc1ccc2nc(-c3cc4ccccc4[nH]3)ncc2c1
InChIInChI=1S/C16H11N3/c1-3-7-13-11(5-1)9-15(18-13)16-17-10-12-6-2-4-8-14(12)19-16/h1-10,18H
InChIKeyBKDUDQVZJQBTJF-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-2-yl)quinazoline?
The IUPAC name of 2-(1H-indol-2-yl)quinazoline (CID 68890263) is 2-(1H-indol-2-yl)quinazoline.
What is the SMILES notation for 2-(1H-indol-2-yl)quinazoline?
The canonical SMILES for 2-(1H-indol-2-yl)quinazoline is c1ccc2nc(-c3cc4ccccc4[nH]3)ncc2c1.
What is the InChIKey of 2-(1H-indol-2-yl)quinazoline?
The InChIKey is BKDUDQVZJQBTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3/c1-3-7-13-11(5-1)9-15(18-13)16-17-10-12-6-2-4-8-14(12)19-16/h1-10,18H.
What are the key properties of 2-(1H-indol-2-yl)quinazoline?
2-(1H-indol-2-yl)quinazoline has a molecular weight of 245.28 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-2-yl)quinazoline is sourced from PubChem (CID 68890263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).