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

C25H18N2O — CID 15448210

IUPAC4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline
SMILESCOc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C25H18N2O/c1-28-22-16-15-17-9-5-6-12-19(17)23(22)24-20-13-7-8-14-21(20)26-25(27-24)18-10-3-2-4-11-18/h2-16H,1H3
InChIKeyPITMVQRYLFJKFP-UHFFFAOYSA-N
MW362.43 g/mol
LogP6.13
Rot. Bonds3

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

4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline (PubChem CID 15448210) has the molecular formula C25H18N2O and a molecular weight of 362.43 g/mol. Its IUPAC name is 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline.

Molecular Properties

Compound Name4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline
PubChem CID15448210
Molecular FormulaC25H18N2O
Molecular Weight362.43 g/mol
Exact Mass362.14
IUPAC Name4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline
SMILESCOc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C25H18N2O/c1-28-22-16-15-17-9-5-6-12-19(17)23(22)24-20-13-7-8-14-21(20)26-25(27-24)18-10-3-2-4-11-18/h2-16H,1H3
InChIKeyPITMVQRYLFJKFP-UHFFFAOYSA-N
XLogP6.13
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.43
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-(2-Methoxyphenyl)quinazoline-2,4-Diamine
CID 53346505
7-(3,4-Dimethoxyphenyl)-6-Methylquinazoline-2,4-Diamine
CID 53346506
7-(2-Ethoxynaphthalen-1-Yl)-6-Methylquinazoline-2,4-Diamine
CID 53346511
2,4-Dicyclohexyl-6-methoxyquinazoline
CID 23640941
6-(2-Methoxyphenyl)-4-quinazolinamine
CID 90054621
6-(3-Methoxyphenyl)quinazolin-4-amine
CID 90054634
7-(2,5-Dimethoxyphenyl)-6-methylquinazoline-2,4-diamine
CID 56676460
2-[4-(2-Methoxy-4-methylphenoxy)quinazolin-1-ium-2-yl]phenolate
CID 1398255
N-tert-butyl-6-(2-methoxyphenyl)-2-(trifluoromethyl)quinazolin-4-amine
CID 5330923
4-Methoxy-2-(4-propoxyphenyl)quinazoline
CID 1612038
2-(3-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
CID 3233294
7-(2-Ethoxyphenyl)quinazoline-2,4-diamine
CID 56666219

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline?
The IUPAC name of 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline (CID 15448210) is 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline.
What is the SMILES notation for 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline?
The canonical SMILES for 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline is COc1ccc2ccccc2c1-c1nc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline?
The InChIKey is PITMVQRYLFJKFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2O/c1-28-22-16-15-17-9-5-6-12-19(17)23(22)24-20-13-7-8-14-21(20)26-25(27-24)18-10-3-2-4-11-18/h2-16H,1H3.
What are the key properties of 4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline?
4-(2-methoxynaphthalen-1-yl)-2-phenylquinazoline has a molecular weight of 362.43 g/mol, XLogP of 6.13, 3 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-phenylquinazoline is sourced from PubChem (CID 15448210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).