[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone

C14H20N4O4S — CID 110253411

IUPAC[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
SMILESCc1nnsc1C(=O)N1CCOC(C)(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H20N4O4S/c1-10-11(23-16-15-10)12(19)18-5-8-22-14(2,9-18)13(20)17-3-6-21-7-4-17/h3-9H2,1-2H3
InChIKeyBVTAOGRPZPZFAA-UHFFFAOYSA-N
MW340.41 g/mol
LogP-0.06
Rot. Bonds2

About [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone

[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone (PubChem CID 110253411) has the molecular formula C14H20N4O4S and a molecular weight of 340.41 g/mol. Its IUPAC name is [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone.

Molecular Properties

Compound Name[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
PubChem CID110253411
Molecular FormulaC14H20N4O4S
Molecular Weight340.41 g/mol
Exact Mass340.12
IUPAC Name[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
SMILESCc1nnsc1C(=O)N1CCOC(C)(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H20N4O4S/c1-10-11(23-16-15-10)12(19)18-5-8-22-14(2,9-18)13(20)17-3-6-21-7-4-17/h3-9H2,1-2H3
InChIKeyBVTAOGRPZPZFAA-UHFFFAOYSA-N
XLogP-0.06
TPSA84.86 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylpyrimidin-5-yl)methanone
CID 110253448
2,1,3-benzothiadiazol-5-yl-[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]methanone
CID 110253410
(4-methylthiadiazol-5-yl)-[3-[2-(morpholine-4-carbonyl)-1-benzothiophen-3-yl]pyrrolidin-1-yl]methanone
CID 110251160
(4-methylthiadiazol-5-yl)-[(3R)-3-[2-(morpholine-4-carbonyl)-1-benzothiophen-3-yl]pyrrolidin-1-yl]methanone
CID 95812755
1-[(2R)-2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 92632639
(4-hydroxy-4-methylazepan-1-yl)-(4-methylthiadiazol-5-yl)methanone
CID 107406650
(4-methylthiadiazol-5-yl)-(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methanone
CID 56863918
[2-methyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]-morpholin-4-ylmethanone
CID 110271141
2-[4-(4-methylthiadiazole-5-carbonyl)morpholin-2-yl]acetic acid
CID 66420176
(2S)-2-[[3-(4-methylphenyl)phenyl]methyl]-4-(4-methylthiadiazole-5-carbonyl)morpholine-2-carboxamide
CID 92558351
4-(morpholine-4-carbonyl)thiadiazole-5-carboxylic acid
CID 117214913
(4-bromopiperidin-1-yl)-(4-methylthiadiazol-5-yl)methanone
CID 80661773

Frequently Asked Questions

What is the IUPAC name of [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The IUPAC name of [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone (CID 110253411) is [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone.
What is the SMILES notation for [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The canonical SMILES for [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone is Cc1nnsc1C(=O)N1CCOC(C)(C(=O)N2CCOCC2)C1.
What is the InChIKey of [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The InChIKey is BVTAOGRPZPZFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O4S/c1-10-11(23-16-15-10)12(19)18-5-8-22-14(2,9-18)13(20)17-3-6-21-7-4-17/h3-9H2,1-2H3.
What are the key properties of [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
[2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone has a molecular weight of 340.41 g/mol, XLogP of -0.06, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-2-(morpholine-4-carbonyl)morpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone is sourced from PubChem (CID 110253411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).