N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide

C15H20N2O4 — CID 102935865

IUPACN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide
SMILESCC1CN(CC(=O)NC(=O)c2ccccc2)CC(CO)O1
InChIInChI=1S/C15H20N2O4/c1-11-7-17(8-13(10-18)21-11)9-14(19)16-15(20)12-5-3-2-4-6-12/h2-6,11,13,18H,7-10H2,1H3,(H,16,19,20)
InChIKeyYFNVEENRQGCUCU-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.02
Rot. Bonds4

About N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide

N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide (PubChem CID 102935865) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide.

Molecular Properties

Compound NameN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide
PubChem CID102935865
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide
SMILESCC1CN(CC(=O)NC(=O)c2ccccc2)CC(CO)O1
InChIInChI=1S/C15H20N2O4/c1-11-7-17(8-13(10-18)21-11)9-14(19)16-15(20)12-5-3-2-4-6-12/h2-6,11,13,18H,7-10H2,1H3,(H,16,19,20)
InChIKeyYFNVEENRQGCUCU-UHFFFAOYSA-N
XLogP0.02
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide?
The IUPAC name of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide (CID 102935865) is N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide.
What is the SMILES notation for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide?
The canonical SMILES for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide is CC1CN(CC(=O)NC(=O)c2ccccc2)CC(CO)O1.
What is the InChIKey of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide?
The InChIKey is YFNVEENRQGCUCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-11-7-17(8-13(10-18)21-11)9-14(19)16-15(20)12-5-3-2-4-6-12/h2-6,11,13,18H,7-10H2,1H3,(H,16,19,20).
What are the key properties of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide?
N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide has a molecular weight of 292.33 g/mol, XLogP of 0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetyl]benzamide is sourced from PubChem (CID 102935865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).