4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine

C17H18N4O2 — CID 3233604

IUPAC4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine
SMILESCc1noc(C)c1-c1ccc2ncnc(N3CCOCC3)c2c1
InChIInChI=1S/C17H18N4O2/c1-11-16(12(2)23-20-11)13-3-4-15-14(9-13)17(19-10-18-15)21-5-7-22-8-6-21/h3-4,9-10H,5-8H2,1-2H3
InChIKeyOPMLBGYWSYWDDN-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.74
Rot. Bonds2

About 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine

4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine (PubChem CID 3233604) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine
PubChem CID3233604
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine
SMILESCc1noc(C)c1-c1ccc2ncnc(N3CCOCC3)c2c1
InChIInChI=1S/C17H18N4O2/c1-11-16(12(2)23-20-11)13-3-4-15-14(9-13)17(19-10-18-15)21-5-7-22-8-6-21/h3-4,9-10H,5-8H2,1-2H3
InChIKeyOPMLBGYWSYWDDN-UHFFFAOYSA-N
XLogP2.74
TPSA64.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-{6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-[(3S)-3-phenylmorpholin-4-yl]quinazolin-2-yl}-1H-pyrazol-1-yl)-2-methylpropan-2-ol
CID 129166067
1-[6-(3,5-Dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]piperidine-4-carboxylic acid
CID 3235557
6-(3,5-dimethyl-4-isoxazolyl)-N-[(3-methoxyphenyl)methyl]-4-quinazolinamine
CID 17757075
N-[4-[[[6-(3,5-dimethyl-4-isoxazolyl)-4-quinazolinyl]amino]methyl]phenyl]acetamide
CID 17757086
2-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-[(3S)-3-phenylmorpholin-4-yl]quinazolin-2-yl]pyrazol-1-yl]-N,N-dimethylacetamide
CID 129165687
1-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-[(2S)-2-phenylpiperazin-1-yl]quinazolin-2-yl]pyrazol-1-yl]-2-methylpropan-2-ol
CID 129165694
N-[(3-chlorophenyl)methyl]-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-6-(3-methyl-1,2-oxazol-4-yl)quinazolin-4-amine
CID 129165698
2-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3-phenylmorpholin-4-yl)quinazolin-2-yl]piperazin-1-yl]-N,N-dimethylethanamine
CID 129165718
4-N-[(3-chlorophenyl)methyl]-2-N-[2-(dimethylamino)ethyl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-N-methylquinazoline-2,4-diamine
CID 129165729
N-[1-(3-chlorophenyl)ethyl]-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-amine
CID 129165750
N-[(2-chlorophenyl)methyl]-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-amine
CID 129165757
2-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylpiperidin-1-yl)quinazolin-2-yl]piperazin-1-yl]-N,N-dimethylethanamine
CID 129165758

Frequently Asked Questions

What is the IUPAC name of 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine?
The IUPAC name of 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine (CID 3233604) is 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine?
The canonical SMILES for 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine is Cc1noc(C)c1-c1ccc2ncnc(N3CCOCC3)c2c1.
What is the InChIKey of 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine?
The InChIKey is OPMLBGYWSYWDDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-11-16(12(2)23-20-11)13-3-4-15-14(9-13)17(19-10-18-15)21-5-7-22-8-6-21/h3-4,9-10H,5-8H2,1-2H3.
What are the key properties of 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine?
4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine has a molecular weight of 310.36 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)quinazolin-4-yl]morpholine is sourced from PubChem (CID 3233604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).