6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine

C20H22N4O2 — CID 141221554

IUPAC6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine
SMILESCOc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OC1CNC1
InChIInChI=1S/C20H22N4O2/c1-13(14-6-4-3-5-7-14)24-20-16-8-19(26-15-10-21-11-15)18(25-2)9-17(16)22-12-23-20/h3-9,12-13,15,21H,10-11H2,1-2H3,(H,22,23,24)/t13-/m1/s1
InChIKeyFXVUHRXNROXQAI-CYBMUJFWSA-N
MW350.42 g/mol
LogP3.16
Rot. Bonds6

About 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine

6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine (PubChem CID 141221554) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine.

Molecular Properties

Compound Name6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine
PubChem CID141221554
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine
SMILESCOc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OC1CNC1
InChIInChI=1S/C20H22N4O2/c1-13(14-6-4-3-5-7-14)24-20-16-8-19(26-15-10-21-11-15)18(25-2)9-17(16)22-12-23-20/h3-9,12-13,15,21H,10-11H2,1-2H3,(H,22,23,24)/t13-/m1/s1
InChIKeyFXVUHRXNROXQAI-CYBMUJFWSA-N
XLogP3.16
TPSA68.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine with MolForge

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Related Compounds

7-methoxy-N-(1-phenylethyl)-6-piperidin-4-yloxyquinazolin-4-amine
CID 69197419
4-[7-methoxy-4-(1-phenylethylamino)quinazolin-6-yl]oxycyclohexan-1-one
CID 67348087
4-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]oxycyclohexan-1-one
CID 58157263
3-[4-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]oxycyclohexyl]-1,1-dimethylurea
CID 59837969
6-iodo-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine
CID 69232909
7-methoxy-4-N-(1-phenylethyl)quinazoline-4,6-diamine
CID 22269913
(2,6-dimethylmorpholin-4-yl)-[4-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]oxypiperidin-1-yl]methanone
CID 59837948
4-[4-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]oxycyclohexyl]piperazin-2-one
CID 59158179
[4-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]oxypiperidin-1-yl]-(oxan-4-yl)methanone
CID 59837956
6,7-dimethoxy-N-(2,2,2-trifluoro-1-phenylethyl)quinazolin-4-amine
CID 18788999
4-[1-(4-fluorophenyl)ethylamino]-7-methoxyquinazolin-6-ol
CID 66755493
6,7-dimethoxy-4-[[(1R)-1-[4-(sulfamoylamino)phenyl]ethyl]amino]quinazoline
CID 150898043

Frequently Asked Questions

What is the IUPAC name of 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine?
The IUPAC name of 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine (CID 141221554) is 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine.
What is the SMILES notation for 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine?
The canonical SMILES for 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine is COc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OC1CNC1.
What is the InChIKey of 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine?
The InChIKey is FXVUHRXNROXQAI-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-13(14-6-4-3-5-7-14)24-20-16-8-19(26-15-10-21-11-15)18(25-2)9-17(16)22-12-23-20/h3-9,12-13,15,21H,10-11H2,1-2H3,(H,22,23,24)/t13-/m1/s1.
What are the key properties of 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine?
6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine has a molecular weight of 350.42 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(azetidin-3-yloxy)-7-methoxy-N-[(1R)-1-phenylethyl]quinazolin-4-amine is sourced from PubChem (CID 141221554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).