3-methoxy-N-morpholin-4-ylbenzamide

C12H16N2O3 — CID 903533

IUPAC3-methoxy-N-morpholin-4-ylbenzamide
SMILESCOc1cccc(C(=O)NN2CCOCC2)c1
InChIInChI=1S/C12H16N2O3/c1-16-11-4-2-3-10(9-11)12(15)13-14-5-7-17-8-6-14/h2-4,9H,5-8H2,1H3,(H,13,15)
InChIKeyXDLLPFHBYJJYTQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.67
Rot. Bonds3

About 3-methoxy-N-morpholin-4-ylbenzamide

3-methoxy-N-morpholin-4-ylbenzamide (PubChem CID 903533) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-methoxy-N-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name3-methoxy-N-morpholin-4-ylbenzamide
PubChem CID903533
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name3-methoxy-N-morpholin-4-ylbenzamide
SMILESCOc1cccc(C(=O)NN2CCOCC2)c1
InChIInChI=1S/C12H16N2O3/c1-16-11-4-2-3-10(9-11)12(15)13-14-5-7-17-8-6-14/h2-4,9H,5-8H2,1H3,(H,13,15)
InChIKeyXDLLPFHBYJJYTQ-UHFFFAOYSA-N
XLogP0.67
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Benzoyl-2-(3-methoxybenzoyl)hydrazine
CID 252264
m-Anisohydrazide
CID 79848
Benzamide, N-tetrahydrofurfuryl-3-methoxy-
CID 531836
3-Methoxy-N-piperidin-4-yl-benzamide
CID 1445157
Morpholino(3-phenoxyphenyl)methanone
CID 6465484
3-methoxy-N-[2-(morpholin-4-yl)ethyl]benzamide
CID 3118713
3-((1-Benzylpiperidin-4-yl)oxy)benzamide
CID 52946209
N'-(3-fluorobenzoyl)-3-methoxybenzohydrazide
CID 790093
N'-cinnamoyl-3-methoxybenzohydrazide
CID 795407
4-[3-(Benzyloxy)benzoyl]morpholine
CID 2982841
2-Ethoxy-N-(morpholin-4-yl)benzamide
CID 4053296
3,5-dimethoxy-N-(morpholin-4-yl)benzamide
CID 4215570

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-morpholin-4-ylbenzamide?
The IUPAC name of 3-methoxy-N-morpholin-4-ylbenzamide (CID 903533) is 3-methoxy-N-morpholin-4-ylbenzamide.
What is the SMILES notation for 3-methoxy-N-morpholin-4-ylbenzamide?
The canonical SMILES for 3-methoxy-N-morpholin-4-ylbenzamide is COc1cccc(C(=O)NN2CCOCC2)c1.
What is the InChIKey of 3-methoxy-N-morpholin-4-ylbenzamide?
The InChIKey is XDLLPFHBYJJYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-16-11-4-2-3-10(9-11)12(15)13-14-5-7-17-8-6-14/h2-4,9H,5-8H2,1H3,(H,13,15).
What are the key properties of 3-methoxy-N-morpholin-4-ylbenzamide?
3-methoxy-N-morpholin-4-ylbenzamide has a molecular weight of 236.27 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-morpholin-4-ylbenzamide is sourced from PubChem (CID 903533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).