N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide

C16H21N3O4 — CID 119712313

IUPACN-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCOCC2)c1)C1COCCN1
InChIInChI=1S/C16H21N3O4/c20-15(14-11-23-7-4-17-14)18-13-3-1-2-12(10-13)16(21)19-5-8-22-9-6-19/h1-3,10,14,17H,4-9,11H2,(H,18,20)
InChIKeyUEKVIRMOAPNNMR-UHFFFAOYSA-N
MW319.36 g/mol
LogP0.09
Rot. Bonds3

About N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide

N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide (PubChem CID 119712313) has the molecular formula C16H21N3O4 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide
PubChem CID119712313
Molecular FormulaC16H21N3O4
Molecular Weight319.36 g/mol
Exact Mass319.15
IUPAC NameN-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCOCC2)c1)C1COCCN1
InChIInChI=1S/C16H21N3O4/c20-15(14-11-23-7-4-17-14)18-13-3-1-2-12(10-13)16(21)19-5-8-22-9-6-19/h1-3,10,14,17H,4-9,11H2,(H,18,20)
InChIKeyUEKVIRMOAPNNMR-UHFFFAOYSA-N
XLogP0.09
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(morpholine-4-carbonyl)phenyl]pyrrolidine-2-carboxamide
CID 119283247
N-(3-carbamoylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119687667
N-[3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119283240
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[3-(morpholine-4-carbonyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119712346
(3S)-N-[3-(trifluoromethyl)phenyl]morpholine-3-carboxamide
CID 129372263
N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]morpholine-3-carboxamide
CID 119712459
[3-(hydroxyamino)phenyl]-morpholin-4-ylmethanone
CID 59690262
N-(3-phenoxyphenyl)morpholine-3-carboxamide
CID 75422303
N-[3-[4-(2-morpholin-4-yl-2-oxoacetyl)piperazine-1-carbonyl]phenyl]cyclohexanecarboxamide
CID 55649623
2-bromo-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
CID 46736679

Frequently Asked Questions

What is the IUPAC name of N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide?
The IUPAC name of N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide (CID 119712313) is N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide?
The canonical SMILES for N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide is O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C1COCCN1.
What is the InChIKey of N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide?
The InChIKey is UEKVIRMOAPNNMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O4/c20-15(14-11-23-7-4-17-14)18-13-3-1-2-12(10-13)16(21)19-5-8-22-9-6-19/h1-3,10,14,17H,4-9,11H2,(H,18,20).
What are the key properties of N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide?
N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide is sourced from PubChem (CID 119712313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).