morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone

C22H24N4O2S — CID 55500958

IUPACmorpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)N1CCOCC1
InChIInChI=1S/C22H24N4O2S/c27-22(25-9-11-28-12-10-25)17-7-4-8-26(14-17)20-18-13-19(16-5-2-1-3-6-16)29-21(18)24-15-23-20/h1-3,5-6,13,15,17H,4,7-12,14H2
InChIKeyLDDSVAUMZASJSF-UHFFFAOYSA-N
MW408.53 g/mol
LogP3.43
Rot. Bonds3

About morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone

morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone (PubChem CID 55500958) has the molecular formula C22H24N4O2S and a molecular weight of 408.53 g/mol. Its IUPAC name is morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone
PubChem CID55500958
Molecular FormulaC22H24N4O2S
Molecular Weight408.53 g/mol
Exact Mass408.16
IUPAC Namemorpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)N1CCOCC1
InChIInChI=1S/C22H24N4O2S/c27-22(25-9-11-28-12-10-25)17-7-4-8-26(14-17)20-18-13-19(16-5-2-1-3-6-16)29-21(18)24-15-23-20/h1-3,5-6,13,15,17H,4,7-12,14H2
InChIKeyLDDSVAUMZASJSF-UHFFFAOYSA-N
XLogP3.43
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.53
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 51286404
[(3R)-1-benzo[g]quinazolin-4-ylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 97018091
[(3S)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]-(4-phenylpiperazin-1-yl)methanone
CID 92877110
(2R)-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 28846771
2,6-dimethyl-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)morpholine
CID 3937786
1-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-phenylpiperidine-3-carboxamide
CID 133408219
(2-hydroxyphenyl)-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone
CID 52676705
(3R)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N-(2-phenylethyl)piperidine-3-carboxamide
CID 92877263
[4-(2,4-dimethylphenyl)piperazin-1-yl]-[1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone
CID 46362908
3-methyl-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-3-carboxylic acid
CID 122052335
(2S,6S)-2,6-dimethyl-4-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]morpholine
CID 51957174
(2S,6R)-2,6-dimethyl-4-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]morpholine
CID 51957173

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone (CID 55500958) is morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone is O=C(C1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone?
The InChIKey is LDDSVAUMZASJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2S/c27-22(25-9-11-28-12-10-25)17-7-4-8-26(14-17)20-18-13-19(16-5-2-1-3-6-16)29-21(18)24-15-23-20/h1-3,5-6,13,15,17H,4,7-12,14H2.
What are the key properties of morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone?
morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone has a molecular weight of 408.53 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]methanone is sourced from PubChem (CID 55500958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).