N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide

C15H20N4O3 — CID 73251784

IUPACN-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)NN1
InChIInChI=1S/C15H20N4O3/c20-14-6-5-13(17-18-14)15(21)16-11-1-3-12(4-2-11)19-7-9-22-10-8-19/h1-4,13,17H,5-10H2,(H,16,21)(H,18,20)
InChIKeyFORBRTRTBCGYMF-UHFFFAOYSA-N
MW304.35 g/mol
LogP0.24
Rot. Bonds3

About N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide

N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide (PubChem CID 73251784) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide
PubChem CID73251784
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC NameN-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)NN1
InChIInChI=1S/C15H20N4O3/c20-14-6-5-13(17-18-14)15(21)16-11-1-3-12(4-2-11)19-7-9-22-10-8-19/h1-4,13,17H,5-10H2,(H,16,21)(H,18,20)
InChIKeyFORBRTRTBCGYMF-UHFFFAOYSA-N
XLogP0.24
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(4-morpholin-4-ylphenyl)pyrrolidine-2-carboxamide
CID 60710547
(2R)-N-(4-morpholin-4-ylphenyl)piperidine-2-carboxamide
CID 103813194
(2S)-N-(4-morpholin-4-ylphenyl)piperidine-2-carboxamide
CID 103813196
5-oxo-N-[4-(3-oxomorpholin-4-yl)phenyl]pyrrolidine-2-carboxamide
CID 110665423
trans-(1R,2R)-2-[(4-morpholin-4-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 27516821
(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
N-(4-morpholin-4-ylphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indazole-3-carboxamide
CID 85133638
4-(methylamino)-N-(4-morpholin-4-ylphenyl)cyclohexane-1-carboxamide
CID 71040468
N-(4-pyrrolidin-1-ylphenyl)oxane-4-carboxamide
CID 30795120
N-[4-(4-methylpiperidin-1-yl)phenyl]-5-oxomorpholine-3-carboxamide
CID 110696844
(2R)-N-(4-pyrrolidin-1-ylphenyl)pyrrolidine-2-carboxamide
CID 93029701
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]-6-oxopiperidine-3-carboxamide
CID 122355146

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide?
The IUPAC name of N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide (CID 73251784) is N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide.
What is the SMILES notation for N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide?
The canonical SMILES for N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide is O=C1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)NN1.
What is the InChIKey of N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide?
The InChIKey is FORBRTRTBCGYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c20-14-6-5-13(17-18-14)15(21)16-11-1-3-12(4-2-11)19-7-9-22-10-8-19/h1-4,13,17H,5-10H2,(H,16,21)(H,18,20).
What are the key properties of N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide?
N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 0.24, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylphenyl)-6-oxodiazinane-3-carboxamide is sourced from PubChem (CID 73251784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).