N-(morpholin-4-ylmethylidene)benzamide

C12H14N2O2 — CID 71741109

IUPACN-(morpholin-4-ylmethylidene)benzamide
SMILESO=C(/N=C/N1CCOCC1)c1ccccc1
InChIInChI=1S/C12H14N2O2/c15-12(11-4-2-1-3-5-11)13-10-14-6-8-16-9-7-14/h1-5,10H,6-9H2/b13-10+
InChIKeyVGUWDFAUMHOIGY-JLHYYAGUSA-N
MW218.26 g/mol
LogP1.19
Rot. Bonds2

About N-(morpholin-4-ylmethylidene)benzamide

N-(morpholin-4-ylmethylidene)benzamide (PubChem CID 71741109) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(morpholin-4-ylmethylidene)benzamide.

Molecular Properties

Compound NameN-(morpholin-4-ylmethylidene)benzamide
PubChem CID71741109
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(morpholin-4-ylmethylidene)benzamide
SMILESO=C(/N=C/N1CCOCC1)c1ccccc1
InChIInChI=1S/C12H14N2O2/c15-12(11-4-2-1-3-5-11)13-10-14-6-8-16-9-7-14/h1-5,10H,6-9H2/b13-10+
InChIKeyVGUWDFAUMHOIGY-JLHYYAGUSA-N
XLogP1.19
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(morpholin-4-ylmethylidene)benzamide?
The IUPAC name of N-(morpholin-4-ylmethylidene)benzamide (CID 71741109) is N-(morpholin-4-ylmethylidene)benzamide.
What is the SMILES notation for N-(morpholin-4-ylmethylidene)benzamide?
The canonical SMILES for N-(morpholin-4-ylmethylidene)benzamide is O=C(/N=C/N1CCOCC1)c1ccccc1.
What is the InChIKey of N-(morpholin-4-ylmethylidene)benzamide?
The InChIKey is VGUWDFAUMHOIGY-JLHYYAGUSA-N. The full InChI is InChI=1S/C12H14N2O2/c15-12(11-4-2-1-3-5-11)13-10-14-6-8-16-9-7-14/h1-5,10H,6-9H2/b13-10+.
What are the key properties of N-(morpholin-4-ylmethylidene)benzamide?
N-(morpholin-4-ylmethylidene)benzamide has a molecular weight of 218.26 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(morpholin-4-ylmethylidene)benzamide is sourced from PubChem (CID 71741109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).