(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone

C20H25N3O3S — CID 110237366

IUPAC(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone
SMILESCC1CN(C(=O)c2cc(-c3ccncc3)c(N3CCOCC3)s2)CC(C)O1
InChIInChI=1S/C20H25N3O3S/c1-14-12-23(13-15(2)26-14)19(24)18-11-17(16-3-5-21-6-4-16)20(27-18)22-7-9-25-10-8-22/h3-6,11,14-15H,7-10,12-13H2,1-2H3
InChIKeyFOFHDSRQSNHPIB-UHFFFAOYSA-N
MW387.51 g/mol
LogP2.90
Rot. Bonds3

About (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone

(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone (PubChem CID 110237366) has the molecular formula C20H25N3O3S and a molecular weight of 387.51 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone
PubChem CID110237366
Molecular FormulaC20H25N3O3S
Molecular Weight387.51 g/mol
Exact Mass387.16
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone
SMILESCC1CN(C(=O)c2cc(-c3ccncc3)c(N3CCOCC3)s2)CC(C)O1
InChIInChI=1S/C20H25N3O3S/c1-14-12-23(13-15(2)26-14)19(24)18-11-17(16-3-5-21-6-4-16)20(27-18)22-7-9-25-10-8-22/h3-6,11,14-15H,7-10,12-13H2,1-2H3
InChIKeyFOFHDSRQSNHPIB-UHFFFAOYSA-N
XLogP2.90
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.51
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone with MolForge

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Related Compounds

(3,5-dimethylpiperidin-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24538398
[(3S)-3-methylpiperidin-1-yl]-(5-morpholin-4-yl-4-pyridin-3-ylthiophen-2-yl)methanone
CID 95856405
azetidin-1-yl-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24515046
N-methyl-5-morpholin-4-yl-N-(1-propan-2-ylpiperidin-4-yl)-4-pyridin-4-ylthiophene-2-carboxamide
CID 46953653
(4-methoxypiperidin-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 55480219
[1-(5-morpholin-4-yl-4-phenylthiophene-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 55469027
(4-benzylpiperazin-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24513631
(4-methylsulfonyl-1,4-diazepan-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24667301
(2,6-dimethylmorpholin-4-yl)-[4-(4-methoxyphenyl)-5-methylthiophen-2-yl]methanone
CID 78774228
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 27515240
(5-morpholin-4-yl-4-pyridin-3-ylthiophen-2-yl)-phenylmethanone
CID 11842439
N-butyl-N-methyl-1-(5-morpholin-4-yl-4-phenylthiophene-2-carbonyl)piperidine-4-carboxamide
CID 55836288

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone (CID 110237366) is (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone is CC1CN(C(=O)c2cc(-c3ccncc3)c(N3CCOCC3)s2)CC(C)O1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone?
The InChIKey is FOFHDSRQSNHPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3S/c1-14-12-23(13-15(2)26-14)19(24)18-11-17(16-3-5-21-6-4-16)20(27-18)22-7-9-25-10-8-22/h3-6,11,14-15H,7-10,12-13H2,1-2H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone?
(2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone has a molecular weight of 387.51 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)methanone is sourced from PubChem (CID 110237366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).