4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine

C23H27N5O2 — CID 139330388

IUPAC4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine
SMILESCc1nccc(C2CCC(Oc3cc(N4CCOCC4)cc4ncncc34)CC2)n1
InChIInChI=1S/C23H27N5O2/c1-16-25-7-6-21(27-16)17-2-4-19(5-3-17)30-23-13-18(28-8-10-29-11-9-28)12-22-20(23)14-24-15-26-22/h6-7,12-15,17,19H,2-5,8-11H2,1H3
InChIKeyCGYLOGXFLWYVFO-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.67
Rot. Bonds4

About 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine

4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine (PubChem CID 139330388) has the molecular formula C23H27N5O2 and a molecular weight of 405.50 g/mol. Its IUPAC name is 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine.

Molecular Properties

Compound Name4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine
PubChem CID139330388
Molecular FormulaC23H27N5O2
Molecular Weight405.50 g/mol
Exact Mass405.22
IUPAC Name4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine
SMILESCc1nccc(C2CCC(Oc3cc(N4CCOCC4)cc4ncncc34)CC2)n1
InChIInChI=1S/C23H27N5O2/c1-16-25-7-6-21(27-16)17-2-4-19(5-3-17)30-23-13-18(28-8-10-29-11-9-28)12-22-20(23)14-24-15-26-22/h6-7,12-15,17,19H,2-5,8-11H2,1H3
InChIKeyCGYLOGXFLWYVFO-UHFFFAOYSA-N
XLogP3.67
TPSA73.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

ethyl N-[4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexyl]carbamate
CID 139338434
N-methyl-2-[[4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexyl]methyl]pyrimidine-4-carboxamide;molecular hydrogen
CID 159374794
1-methyl-8-[4-[(2-methylpyrimidin-4-yl)amino]cyclohexyl]oxy-6-morpholin-4-ylquinoxalin-2-one
CID 139342847
molecular hydrogen;7-morpholin-4-ylquinazolin-5-ol;(4-pyrimidin-2-yloxycyclohexyl) methanesulfonate;4-[5-(4-pyrimidin-2-yloxycyclohexyl)oxyquinazolin-7-yl]morpholine
CID 162183203
3-methyl-5-[4-[(2-methylpyrimidin-4-yl)amino]cyclohexyl]oxy-7-morpholin-4-ylquinazolin-4-one
CID 139330620
lithium;ethyl 4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexane-1-carboxylate;methanamine;N-methyl-4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexane-1-carboxamide;4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexane-1-carboxylic acid;oxolane;hydroxide
CID 159593215
4-[(2-chlorofuro[3,2-d]pyrimidin-4-yl)amino]cyclohexan-1-ol;2-methyl-N-[4-(7-morpholin-4-ylquinazolin-5-yl)oxycyclohexyl]-6,7-dihydrofuro[3,2-d]pyrimidin-4-amine
CID 139330580
4-[8-[4-[(2,5-dimethylpyrimidin-4-yl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 158204207
5-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-3-amine
CID 121335923
5-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine
CID 121335808
4-[8-[4-[(2-methylpyrimidin-5-yl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 158858413
2-N,2-N-dimethyl-4-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidine-2,4-diamine
CID 121335685

Frequently Asked Questions

What is the IUPAC name of 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine?
The IUPAC name of 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine (CID 139330388) is 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine.
What is the SMILES notation for 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine?
The canonical SMILES for 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine is Cc1nccc(C2CCC(Oc3cc(N4CCOCC4)cc4ncncc34)CC2)n1.
What is the InChIKey of 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine?
The InChIKey is CGYLOGXFLWYVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O2/c1-16-25-7-6-21(27-16)17-2-4-19(5-3-17)30-23-13-18(28-8-10-29-11-9-28)12-22-20(23)14-24-15-26-22/h6-7,12-15,17,19H,2-5,8-11H2,1H3.
What are the key properties of 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine?
4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine has a molecular weight of 405.50 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[4-(2-methylpyrimidin-4-yl)cyclohexyl]oxyquinazolin-7-yl]morpholine is sourced from PubChem (CID 139330388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).