4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine

C22H25N3O2 — CID 158577556

IUPAC4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine
SMILESCc1ccc(COc2cc(N3CCOCC3)cc3nc(C)nc(C)c23)cc1
InChIInChI=1S/C22H25N3O2/c1-15-4-6-18(7-5-15)14-27-21-13-19(25-8-10-26-11-9-25)12-20-22(21)16(2)23-17(3)24-20/h4-7,12-13H,8-11,14H2,1-3H3
InChIKeyPQDOSRSFGUMJBN-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.97
Rot. Bonds4

About 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine

4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine (PubChem CID 158577556) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine.

Molecular Properties

Compound Name4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine
PubChem CID158577556
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine
SMILESCc1ccc(COc2cc(N3CCOCC3)cc3nc(C)nc(C)c23)cc1
InChIInChI=1S/C22H25N3O2/c1-15-4-6-18(7-5-15)14-27-21-13-19(25-8-10-26-11-9-25)12-20-22(21)16(2)23-17(3)24-20/h4-7,12-13H,8-11,14H2,1-3H3
InChIKeyPQDOSRSFGUMJBN-UHFFFAOYSA-N
XLogP3.97
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-[(4-methoxyphenyl)methoxy]-2-methylquinazolin-7-yl]morpholine
CID 139330647
3-[(4-methoxyphenyl)methoxy]-5-morpholin-4-ylbenzene-1,2-diamine
CID 139342854
9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 23586726
16-(4-methylphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71419396
3-[(4-methoxyphenyl)methoxy]-5-morpholin-4-yl-2-nitroaniline
CID 139331354
8-ethoxy-1,3-dimethyl-6-morpholin-4-ylquinoxalin-2-one
CID 167296663
4-[3-[2-(4-methylphenyl)ethyl]phenyl]morpholine
CID 59545940
4-morpholin-4-yl-2-phenylmethoxybenzoic acid
CID 139820308
(4-methylphenyl)methyl 4-morpholin-4-ylpyridin-1-ium-2-carboxylate
CID 8000032
ethane;(4-methylphenyl)-[4-[(4-morpholin-4-ylphenyl)diazenyl]phenyl]diazene
CID 157373423
4-[3-[3-methyl-2-[(4-methylphenoxy)methyl]benzimidazol-5-yl]oxyphenyl]morpholine
CID 144678920
2-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-[(4-methylphenyl)methoxy]pyran-4-one
CID 7178463

Frequently Asked Questions

What is the IUPAC name of 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine?
The IUPAC name of 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine (CID 158577556) is 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine.
What is the SMILES notation for 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine?
The canonical SMILES for 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine is Cc1ccc(COc2cc(N3CCOCC3)cc3nc(C)nc(C)c23)cc1.
What is the InChIKey of 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine?
The InChIKey is PQDOSRSFGUMJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-15-4-6-18(7-5-15)14-27-21-13-19(25-8-10-26-11-9-25)12-20-22(21)16(2)23-17(3)24-20/h4-7,12-13H,8-11,14H2,1-3H3.
What are the key properties of 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine?
4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine has a molecular weight of 363.46 g/mol, XLogP of 3.97, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine is sourced from PubChem (CID 158577556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).