4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline

C20H16N2O — CID 15506455

IUPAC4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline
SMILESCOc1ccc2ccccc2c1-c1nc(C)nc2ccccc12
InChIInChI=1S/C20H16N2O/c1-13-21-17-10-6-5-9-16(17)20(22-13)19-15-8-4-3-7-14(15)11-12-18(19)23-2/h3-12H,1-2H3
InChIKeyBPZATXYOJJAHAD-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.77
Rot. Bonds2

About 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline

4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline (PubChem CID 15506455) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline.

Molecular Properties

Compound Name4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline
PubChem CID15506455
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline
SMILESCOc1ccc2ccccc2c1-c1nc(C)nc2ccccc12
InChIInChI=1S/C20H16N2O/c1-13-21-17-10-6-5-9-16(17)20(22-13)19-15-8-4-3-7-14(15)11-12-18(19)23-2/h3-12H,1-2H3
InChIKeyBPZATXYOJJAHAD-UHFFFAOYSA-N
XLogP4.77
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline?
The IUPAC name of 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline (CID 15506455) is 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline.
What is the SMILES notation for 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline?
The canonical SMILES for 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline is COc1ccc2ccccc2c1-c1nc(C)nc2ccccc12.
What is the InChIKey of 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline?
The InChIKey is BPZATXYOJJAHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-13-21-17-10-6-5-9-16(17)20(22-13)19-15-8-4-3-7-14(15)11-12-18(19)23-2/h3-12H,1-2H3.
What are the key properties of 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline?
4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline has a molecular weight of 300.36 g/mol, XLogP of 4.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline is sourced from PubChem (CID 15506455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).