2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide

C20H25N3O3 — CID 53195525

IUPAC2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide
SMILESCc1ccccc1C(=O)NCc1nc(C(=O)N2CCC(C)CC2)c(C)o1
InChIInChI=1S/C20H25N3O3/c1-13-8-10-23(11-9-13)20(25)18-15(3)26-17(22-18)12-21-19(24)16-7-5-4-6-14(16)2/h4-7,13H,8-12H2,1-3H3,(H,21,24)
InChIKeyYVBPELKJIYTWHH-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.09
Rot. Bonds4

About 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide

2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide (PubChem CID 53195525) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide
PubChem CID53195525
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide
SMILESCc1ccccc1C(=O)NCc1nc(C(=O)N2CCC(C)CC2)c(C)o1
InChIInChI=1S/C20H25N3O3/c1-13-8-10-23(11-9-13)20(25)18-15(3)26-17(22-18)12-21-19(24)16-7-5-4-6-14(16)2/h4-7,13H,8-12H2,1-3H3,(H,21,24)
InChIKeyYVBPELKJIYTWHH-UHFFFAOYSA-N
XLogP3.09
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide?
The IUPAC name of 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide (CID 53195525) is 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide.
What is the SMILES notation for 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide?
The canonical SMILES for 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide is Cc1ccccc1C(=O)NCc1nc(C(=O)N2CCC(C)CC2)c(C)o1.
What is the InChIKey of 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide?
The InChIKey is YVBPELKJIYTWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-13-8-10-23(11-9-13)20(25)18-15(3)26-17(22-18)12-21-19(24)16-7-5-4-6-14(16)2/h4-7,13H,8-12H2,1-3H3,(H,21,24).
What are the key properties of 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide?
2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide has a molecular weight of 355.44 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]benzamide is sourced from PubChem (CID 53195525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).