3-methyl-N-(4-morpholin-2-ylphenyl)benzamide

C18H20N2O2 — CID 67240729

IUPAC3-methyl-N-(4-morpholin-2-ylphenyl)benzamide
SMILESCc1cccc(C(=O)Nc2ccc(C3CNCCO3)cc2)c1
InChIInChI=1S/C18H20N2O2/c1-13-3-2-4-15(11-13)18(21)20-16-7-5-14(6-8-16)17-12-19-9-10-22-17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21)
InChIKeyHBAIRMSEXNWAOJ-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.91
Rot. Bonds3

About 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide

3-methyl-N-(4-morpholin-2-ylphenyl)benzamide (PubChem CID 67240729) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(4-morpholin-2-ylphenyl)benzamide
PubChem CID67240729
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name3-methyl-N-(4-morpholin-2-ylphenyl)benzamide
SMILESCc1cccc(C(=O)Nc2ccc(C3CNCCO3)cc2)c1
InChIInChI=1S/C18H20N2O2/c1-13-3-2-4-15(11-13)18(21)20-16-7-5-14(6-8-16)17-12-19-9-10-22-17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21)
InChIKeyHBAIRMSEXNWAOJ-UHFFFAOYSA-N
XLogP2.91
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide?
The IUPAC name of 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide (CID 67240729) is 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide.
What is the SMILES notation for 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide?
The canonical SMILES for 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide is Cc1cccc(C(=O)Nc2ccc(C3CNCCO3)cc2)c1.
What is the InChIKey of 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide?
The InChIKey is HBAIRMSEXNWAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13-3-2-4-15(11-13)18(21)20-16-7-5-14(6-8-16)17-12-19-9-10-22-17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21).
What are the key properties of 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide?
3-methyl-N-(4-morpholin-2-ylphenyl)benzamide has a molecular weight of 296.37 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-morpholin-2-ylphenyl)benzamide is sourced from PubChem (CID 67240729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).