N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine

C20H22N4O — CID 675240

IUPACN-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1
InChIInChI=1S/C20H22N4O/c1-2-6-16(7-3-1)19-22-18-9-5-4-8-17(18)20(23-19)21-10-11-24-12-14-25-15-13-24/h1-9H,10-15H2,(H,21,22,23)
InChIKeyZQIFDOULZQNKEF-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.04
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine

N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine (PubChem CID 675240) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine
PubChem CID675240
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC NameN-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1
InChIInChI=1S/C20H22N4O/c1-2-6-16(7-3-1)19-22-18-9-5-4-8-17(18)20(23-19)21-10-11-24-12-14-25-15-13-24/h1-9H,10-15H2,(H,21,22,23)
InChIKeyZQIFDOULZQNKEF-UHFFFAOYSA-N
XLogP3.04
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine (CID 675240) is N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine is c1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine?
The InChIKey is ZQIFDOULZQNKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-2-6-16(7-3-1)19-22-18-9-5-4-8-17(18)20(23-19)21-10-11-24-12-14-25-15-13-24/h1-9H,10-15H2,(H,21,22,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine?
N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine has a molecular weight of 334.42 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-phenylquinazolin-4-amine is sourced from PubChem (CID 675240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).