2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide

C18H25N3O3 — CID 3218480

IUPAC2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)NC1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C18H25N3O3/c1-14-4-2-3-5-16(14)17(22)19-15-6-8-20(9-7-15)18(23)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,22)
InChIKeyTUQFHJUNZYLQIL-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.64
Rot. Bonds2

About 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide

2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide (PubChem CID 3218480) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide
PubChem CID3218480
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)NC1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C18H25N3O3/c1-14-4-2-3-5-16(14)17(22)19-15-6-8-20(9-7-15)18(23)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,22)
InChIKeyTUQFHJUNZYLQIL-UHFFFAOYSA-N
XLogP1.64
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide (CID 3218480) is 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide is Cc1ccccc1C(=O)NC1CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide?
The InChIKey is TUQFHJUNZYLQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-14-4-2-3-5-16(14)17(22)19-15-6-8-20(9-7-15)18(23)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,22).
What are the key properties of 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide?
2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide has a molecular weight of 331.42 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(morpholine-4-carbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 3218480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).