3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide

C22H28N4O5 — CID 26010903

IUPAC3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1
InChIInChI=1S/C22H28N4O5/c1-14-4-5-21(31-14)20(26-6-8-30-9-7-26)13-23-22(29)17-10-18(24-15(2)27)12-19(11-17)25-16(3)28/h4-5,10-12,20H,6-9,13H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t20-/m1/s1
InChIKeySLSIHKWNSIONRO-HXUWFJFHSA-N
MW428.49 g/mol
LogP2.31
Rot. Bonds7

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

3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 26010903) has the molecular formula C22H28N4O5 and a molecular weight of 428.49 g/mol. Its IUPAC name is 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

Compound Name3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
PubChem CID26010903
Molecular FormulaC22H28N4O5
Molecular Weight428.49 g/mol
Exact Mass428.21
IUPAC Name3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1
InChIInChI=1S/C22H28N4O5/c1-14-4-5-21(31-14)20(26-6-8-30-9-7-26)13-23-22(29)17-10-18(24-15(2)27)12-19(11-17)25-16(3)28/h4-5,10-12,20H,6-9,13H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t20-/m1/s1
InChIKeySLSIHKWNSIONRO-HXUWFJFHSA-N
XLogP2.31
TPSA112.91 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide with MolForge

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Launch Full Analysis

Related Compounds

3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 18164168
4-bromo-3,5-dimethoxy-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 24643793
2,5-dimethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]furan-3-carboxamide
CID 18164174
5-bromo-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-3-carboxamide
CID 42895264
1-acetyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2,3-dihydroindole-5-carboxamide
CID 24643806
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-(2-phenylethynyl)benzamide
CID 24643832
1-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-phenylurea
CID 30089006
2-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-1,3-benzoxazole-6-carboxamide
CID 99942348
5-methoxy-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide
CID 24643768
2,5-dichloro-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 18168876
2-amino-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 119837790
N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3,4-dihydro-2H-chromene-6-carboxamide
CID 126423370

Frequently Asked Questions

What is the IUPAC name of 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The IUPAC name of 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (CID 26010903) is 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.
What is the SMILES notation for 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The canonical SMILES for 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1.
What is the InChIKey of 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
The InChIKey is SLSIHKWNSIONRO-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H28N4O5/c1-14-4-5-21(31-14)20(26-6-8-30-9-7-26)13-23-22(29)17-10-18(24-15(2)27)12-19(11-17)25-16(3)28/h4-5,10-12,20H,6-9,13H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t20-/m1/s1.
What are the key properties of 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?
3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 428.49 g/mol, XLogP of 2.31, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diacetamido-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 26010903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).