2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

C20H22N2O3 — CID 6471014

IUPAC2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1
InChIInChI=1S/C20H22N2O3/c1-15-3-2-4-16(13-15)14-19(23)21-18-7-5-17(6-8-18)20(24)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3,(H,21,23)
InChIKeyCLNHORHXSVPVJF-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.65
Rot. Bonds4

About 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 6471014) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID6471014
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1
InChIInChI=1S/C20H22N2O3/c1-15-3-2-4-16(13-15)14-19(23)21-18-7-5-17(6-8-18)20(24)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3,(H,21,23)
InChIKeyCLNHORHXSVPVJF-UHFFFAOYSA-N
XLogP2.65
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (CID 6471014) is 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is Cc1cccc(CC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1.
What is the InChIKey of 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is CLNHORHXSVPVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-15-3-2-4-16(13-15)14-19(23)21-18-7-5-17(6-8-18)20(24)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3,(H,21,23).
What are the key properties of 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 6471014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).