6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline

C26H18N2 — CID 71594669

IUPAC6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline
SMILESCc1cc2ccccc2cc1-c1nc2ccccc2c2cc3ccccc3n12
InChIInChI=1S/C26H18N2/c1-17-14-18-8-2-3-9-19(18)15-22(17)26-27-23-12-6-5-11-21(23)25-16-20-10-4-7-13-24(20)28(25)26/h2-16H,1H3
InChIKeyXKJZQEKBMATUTA-UHFFFAOYSA-N
MW358.44 g/mol
LogP6.77
Rot. Bonds1

About 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline

6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline (PubChem CID 71594669) has the molecular formula C26H18N2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline
PubChem CID71594669
Molecular FormulaC26H18N2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC Name6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline
SMILESCc1cc2ccccc2cc1-c1nc2ccccc2c2cc3ccccc3n12
InChIInChI=1S/C26H18N2/c1-17-14-18-8-2-3-9-19(18)15-22(17)26-27-23-12-6-5-11-21(23)25-16-20-10-4-7-13-24(20)28(25)26/h2-16H,1H3
InChIKeyXKJZQEKBMATUTA-UHFFFAOYSA-N
XLogP6.77
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The IUPAC name of 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline (CID 71594669) is 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline.
What is the SMILES notation for 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The canonical SMILES for 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline is Cc1cc2ccccc2cc1-c1nc2ccccc2c2cc3ccccc3n12.
What is the InChIKey of 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
The InChIKey is XKJZQEKBMATUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-17-14-18-8-2-3-9-19(18)15-22(17)26-27-23-12-6-5-11-21(23)25-16-20-10-4-7-13-24(20)28(25)26/h2-16H,1H3.
What are the key properties of 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline?
6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline has a molecular weight of 358.44 g/mol, XLogP of 6.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methylnaphthalen-2-yl)indolo[1,2-c]quinazoline is sourced from PubChem (CID 71594669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).