3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide

C19H24N2O3 — CID 18164168

IUPAC3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESCc1cccc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)c1
InChIInChI=1S/C19H24N2O3/c1-14-4-3-5-16(12-14)19(22)20-13-17(18-7-6-15(2)24-18)21-8-10-23-11-9-21/h3-7,12,17H,8-11,13H2,1-2H3,(H,20,22)
InChIKeyQLZINIPBPFHUGA-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.70
Rot. Bonds5

About 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide

3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 18164168) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
PubChem CID18164168
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESCc1cccc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)c1
InChIInChI=1S/C19H24N2O3/c1-14-4-3-5-16(12-14)19(22)20-13-17(18-7-6-15(2)24-18)21-8-10-23-11-9-21/h3-7,12,17H,8-11,13H2,1-2H3,(H,20,22)
InChIKeyQLZINIPBPFHUGA-UHFFFAOYSA-N
XLogP2.70
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The IUPAC name of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (CID 18164168) is 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.
What is the SMILES notation for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The canonical SMILES for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is Cc1cccc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)c1.
What is the InChIKey of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The InChIKey is QLZINIPBPFHUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-14-4-3-5-16(12-14)19(22)20-13-17(18-7-6-15(2)24-18)21-8-10-23-11-9-21/h3-7,12,17H,8-11,13H2,1-2H3,(H,20,22).
What are the key properties of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 328.41 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 18164168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).