4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine

C22H20N4OS — CID 2547146

IUPAC4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESCc1sc2nc(-c3cccnc3)nc(N3CCOCC3)c2c1-c1ccccc1
InChIInChI=1S/C22H20N4OS/c1-15-18(16-6-3-2-4-7-16)19-21(26-10-12-27-13-11-26)24-20(25-22(19)28-15)17-8-5-9-23-14-17/h2-9,14H,10-13H2,1H3
InChIKeyQDVOAJSUDSQJQP-UHFFFAOYSA-N
MW388.50 g/mol
LogP4.57
Rot. Bonds3

About 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine

4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine (PubChem CID 2547146) has the molecular formula C22H20N4OS and a molecular weight of 388.50 g/mol. Its IUPAC name is 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine
PubChem CID2547146
Molecular FormulaC22H20N4OS
Molecular Weight388.50 g/mol
Exact Mass388.14
IUPAC Name4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESCc1sc2nc(-c3cccnc3)nc(N3CCOCC3)c2c1-c1ccccc1
InChIInChI=1S/C22H20N4OS/c1-15-18(16-6-3-2-4-7-16)19-21(26-10-12-27-13-11-26)24-20(25-22(19)28-15)17-8-5-9-23-14-17/h2-9,14H,10-13H2,1H3
InChIKeyQDVOAJSUDSQJQP-UHFFFAOYSA-N
XLogP4.57
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.50
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-morpholin-4-yl-2-pyridin-3-ylthieno[2,3-d]pyrimidine-6-carboxylic acid
CID 59817867
[4-[(7S)-7-methyl-2-pyridin-3-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 41023542
4-(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)-N,N-dimethylpiperazine-1-sulfonamide
CID 154807100
2-chloro-6-methyl-5-phenyl-4-piperazin-1-ylthieno[2,3-d]pyrimidine
CID 82065647
4-[[4-(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-3,5-dimethyl-1,2-oxazole
CID 167904296
4-(4-pyridin-3-yl-8-thia-3,5,10,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl)morpholine
CID 57334271
4-(4-methylpiperidin-1-yl)-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidine
CID 2575882
ethyl 4-methyl-6-morpholin-4-yl-2-pyridin-3-ylpyrimidine-5-carboxylate
CID 139881750
N-[3-(4-morpholin-4-yl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-6-yl)phenyl]acetamide
CID 59829571
4-[6-[(4-methylpiperazin-1-yl)methyl]-2-pyridin-3-ylthieno[3,2-d]pyrimidin-4-yl]morpholine
CID 24947792
4-(azetidin-1-yl)-6-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidine
CID 18287230
4-(2-pyridin-4-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)morpholine
CID 155807821

Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine (CID 2547146) is 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine is Cc1sc2nc(-c3cccnc3)nc(N3CCOCC3)c2c1-c1ccccc1.
What is the InChIKey of 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The InChIKey is QDVOAJSUDSQJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4OS/c1-15-18(16-6-3-2-4-7-16)19-21(26-10-12-27-13-11-26)24-20(25-22(19)28-15)17-8-5-9-23-14-17/h2-9,14H,10-13H2,1H3.
What are the key properties of 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine?
4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine has a molecular weight of 388.50 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 2547146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).