6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine

C20H22N4O3 — CID 71738609

IUPAC6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine
SMILESCOc1cc2nc(N3CCOCC3)nc(Nc3ccccc3)c2cc1OC
InChIInChI=1S/C20H22N4O3/c1-25-17-12-15-16(13-18(17)26-2)22-20(24-8-10-27-11-9-24)23-19(15)21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,21,22,23)
InChIKeyHKXUNUNPALUAPG-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.23
Rot. Bonds5

About 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine

6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine (PubChem CID 71738609) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine.

Molecular Properties

Compound Name6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine
PubChem CID71738609
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine
SMILESCOc1cc2nc(N3CCOCC3)nc(Nc3ccccc3)c2cc1OC
InChIInChI=1S/C20H22N4O3/c1-25-17-12-15-16(13-18(17)26-2)22-20(24-8-10-27-11-9-24)23-19(15)21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,21,22,23)
InChIKeyHKXUNUNPALUAPG-UHFFFAOYSA-N
XLogP3.23
TPSA68.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6,7-dimethoxy-N-(4-morpholin-4-ylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine
CID 117084289
2-chloro-6,7-dimethoxy-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine
CID 22693013
2-(4,4-difluoropiperidin-1-yl)-6,7-dimethoxy-N-phenylquinazolin-4-amine;2,2,2-trifluoroacetic acid
CID 164625166
4-(4,6,7-trimethoxyquinazolin-2-yl)morpholine
CID 22082862
2-N-[3-(dimethylamino)phenyl]-6,7-dimethoxy-4-N-(4-morpholin-4-ylphenyl)quinazoline-2,4-diamine
CID 117079834
6,7-dimethoxy-N-(2-methylphenyl)-2-pyrrolidin-1-ylquinazolin-4-amine;hydrochloride
CID 162676134
6,7-dimethoxy-2-(6-morpholin-4-yl-3-pyridinyl)-N-(4-phenoxyphenyl)quinazolin-4-amine
CID 117087831
4-N-(2-chloro-6,7-dimethoxyquinazolin-4-yl)-1-N-phenylbenzene-1,4-diamine
CID 22693012
4-[6,7-dimethoxy-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]morpholine
CID 139592902
N-[6,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-yl]-N',N'-dimethylethane-1,2-diamine
CID 11774935
4-methoxy-6-morpholin-4-yl-N-phenyl-1,3,5-triazin-2-amine
CID 1077239
6,7-dimethoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(oxan-4-yl)quinazolin-4-amine
CID 44604814

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine?
The IUPAC name of 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine (CID 71738609) is 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine.
What is the SMILES notation for 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine?
The canonical SMILES for 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine is COc1cc2nc(N3CCOCC3)nc(Nc3ccccc3)c2cc1OC.
What is the InChIKey of 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine?
The InChIKey is HKXUNUNPALUAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-25-17-12-15-16(13-18(17)26-2)22-20(24-8-10-27-11-9-24)23-19(15)21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,21,22,23).
What are the key properties of 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine?
6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine has a molecular weight of 366.42 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-2-morpholin-4-yl-N-phenylquinazolin-4-amine is sourced from PubChem (CID 71738609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).