2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide

C20H22N2O3 — CID 110286907

IUPAC2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide
SMILESCc1ccccc1C(=O)N[C@H](C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-15-7-5-6-10-17(15)19(23)21-18(16-8-3-2-4-9-16)20(24)22-11-13-25-14-12-22/h2-10,18H,11-14H2,1H3,(H,21,23)/t18-/m0/s1
InChIKeyFEVMPHYOQAAAJV-SFHVURJKSA-N
MW338.41 g/mol
LogP2.32
Rot. Bonds4

About 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide

2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide (PubChem CID 110286907) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide
PubChem CID110286907
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide
SMILESCc1ccccc1C(=O)N[C@H](C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-15-7-5-6-10-17(15)19(23)21-18(16-8-3-2-4-9-16)20(24)22-11-13-25-14-12-22/h2-10,18H,11-14H2,1H3,(H,21,23)/t18-/m0/s1
InChIKeyFEVMPHYOQAAAJV-SFHVURJKSA-N
XLogP2.32
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 ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide?
The IUPAC name of 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide (CID 110286907) is 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide.
What is the SMILES notation for 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide?
The canonical SMILES for 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide is Cc1ccccc1C(=O)N[C@H](C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide?
The InChIKey is FEVMPHYOQAAAJV-SFHVURJKSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-15-7-5-6-10-17(15)19(23)21-18(16-8-3-2-4-9-16)20(24)22-11-13-25-14-12-22/h2-10,18H,11-14H2,1H3,(H,21,23)/t18-/m0/s1.
What are the key properties of 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide?
2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide has a molecular weight of 338.41 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide is sourced from PubChem (CID 110286907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).