4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide

C15H20N2O3 — CID 2977005

IUPAC4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide
SMILESCc1ccc(C(=O)NCCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C15H20N2O3/c1-12-2-4-13(5-3-12)15(19)16-7-6-14(18)17-8-10-20-11-9-17/h2-5H,6-11H2,1H3,(H,16,19)
InChIKeyZNMOLDJXNUWRQY-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.97
Rot. Bonds4

About 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide

4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide (PubChem CID 2977005) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide
PubChem CID2977005
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide
SMILESCc1ccc(C(=O)NCCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C15H20N2O3/c1-12-2-4-13(5-3-12)15(19)16-7-6-14(18)17-8-10-20-11-9-17/h2-5H,6-11H2,1H3,(H,16,19)
InChIKeyZNMOLDJXNUWRQY-UHFFFAOYSA-N
XLogP0.97
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide?
The IUPAC name of 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide (CID 2977005) is 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide.
What is the SMILES notation for 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide?
The canonical SMILES for 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide is Cc1ccc(C(=O)NCCC(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide?
The InChIKey is ZNMOLDJXNUWRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-12-2-4-13(5-3-12)15(19)16-7-6-14(18)17-8-10-20-11-9-17/h2-5H,6-11H2,1H3,(H,16,19).
What are the key properties of 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide?
4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide has a molecular weight of 276.34 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide is sourced from PubChem (CID 2977005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).