6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine

C20H26N4O — CID 118475339

IUPAC6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
SMILESC=Cc1ccc2ncnc(NC3CCC(N4CCOCC4)CC3)c2c1
InChIInChI=1S/C20H26N4O/c1-2-15-3-8-19-18(13-15)20(22-14-21-19)23-16-4-6-17(7-5-16)24-9-11-25-12-10-24/h2-3,8,13-14,16-17H,1,4-7,9-12H2,(H,21,22,23)
InChIKeyOEDQGEXTSQGQQD-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.33
Rot. Bonds4

About 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine

6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine (PubChem CID 118475339) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine.

Molecular Properties

Compound Name6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
PubChem CID118475339
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC Name6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
SMILESC=Cc1ccc2ncnc(NC3CCC(N4CCOCC4)CC3)c2c1
InChIInChI=1S/C20H26N4O/c1-2-15-3-8-19-18(13-15)20(22-14-21-19)23-16-4-6-17(7-5-16)24-9-11-25-12-10-24/h2-3,8,13-14,16-17H,1,4-7,9-12H2,(H,21,22,23)
InChIKeyOEDQGEXTSQGQQD-UHFFFAOYSA-N
XLogP3.33
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-methoxyethenyl)-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 123964283
6-(methoxymethyl)-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 118475288
2-[4-[(4-morpholin-4-ylcyclohexyl)amino]quinazolin-6-yl]acetonitrile
CID 118475287
6-butyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 121255036
6-(2-methyl-1H-imidazol-5-yl)-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 130446838
7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 121255066
3-[4-[(4-morpholin-4-ylcyclohexyl)amino]quinazolin-6-yl]cyclohex-3-en-1-one
CID 130236172
N-[4-(6-azaspiro[2.5]octan-6-yl)cyclohexyl]-6-bromoquinazolin-4-amine
CID 118475382
5-bromo-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 140800582
4-N-[4-(4-methylpiperazin-1-yl)cyclohexyl]quinazoline-4,6-diamine
CID 146237654
6-bromo-N-[1-(oxolan-3-yl)piperidin-4-yl]quinazolin-4-amine
CID 133381158
N-[4-(4,4-dimethylpiperidin-1-yl)cyclohexyl]-6-ethylquinazolin-4-amine
CID 118475354

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The IUPAC name of 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine (CID 118475339) is 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine.
What is the SMILES notation for 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The canonical SMILES for 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine is C=Cc1ccc2ncnc(NC3CCC(N4CCOCC4)CC3)c2c1.
What is the InChIKey of 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The InChIKey is OEDQGEXTSQGQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-2-15-3-8-19-18(13-15)20(22-14-21-19)23-16-4-6-17(7-5-16)24-9-11-25-12-10-24/h2-3,8,13-14,16-17H,1,4-7,9-12H2,(H,21,22,23).
What are the key properties of 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine has a molecular weight of 338.45 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine is sourced from PubChem (CID 118475339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).