4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine

C21H26N4O2 — CID 69042108

IUPAC4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine
SMILESCCOc1ccccc1C1(NC)N=C(N2CCOCC2)Nc2ccccc21
InChIInChI=1S/C21H26N4O2/c1-3-27-19-11-7-5-9-17(19)21(22-2)16-8-4-6-10-18(16)23-20(24-21)25-12-14-26-15-13-25/h4-11,22H,3,12-15H2,1-2H3,(H,23,24)
InChIKeyFAOHJLOVONCUSX-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.62
Rot. Bonds4

About 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine

4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine (PubChem CID 69042108) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine.

Molecular Properties

Compound Name4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine
PubChem CID69042108
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine
SMILESCCOc1ccccc1C1(NC)N=C(N2CCOCC2)Nc2ccccc21
InChIInChI=1S/C21H26N4O2/c1-3-27-19-11-7-5-9-17(19)21(22-2)16-8-4-6-10-18(16)23-20(24-21)25-12-14-26-15-13-25/h4-11,22H,3,12-15H2,1-2H3,(H,23,24)
InChIKeyFAOHJLOVONCUSX-UHFFFAOYSA-N
XLogP2.62
TPSA58.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine?
The IUPAC name of 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine (CID 69042108) is 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine.
What is the SMILES notation for 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine?
The canonical SMILES for 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine is CCOc1ccccc1C1(NC)N=C(N2CCOCC2)Nc2ccccc21.
What is the InChIKey of 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine?
The InChIKey is FAOHJLOVONCUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-3-27-19-11-7-5-9-17(19)21(22-2)16-8-4-6-10-18(16)23-20(24-21)25-12-14-26-15-13-25/h4-11,22H,3,12-15H2,1-2H3,(H,23,24).
What are the key properties of 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine?
4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine has a molecular weight of 366.47 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenyl)-N-methyl-2-morpholin-4-yl-1H-quinazolin-4-amine is sourced from PubChem (CID 69042108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).