2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide

C14H20N4O3 — CID 129477089

IUPAC2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(Cc2ccc(C#N)o2)CCO1
InChIInChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m1/s1
InChIKeyYLRPOHMBTDDIQY-CYBMUJFWSA-N
MW292.34 g/mol
LogP-0.23
Rot. Bonds6

About 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide

2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide (PubChem CID 129477089) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound Name2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
PubChem CID129477089
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(Cc2ccc(C#N)o2)CCO1
InChIInChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m1/s1
InChIKeyYLRPOHMBTDDIQY-CYBMUJFWSA-N
XLogP-0.23
TPSA95.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The IUPAC name of 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide (CID 129477089) is 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide is CN(CC(N)=O)C[C@@H]1CN(Cc2ccc(C#N)o2)CCO1.
What is the InChIKey of 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The InChIKey is YLRPOHMBTDDIQY-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m1/s1.
What are the key properties of 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide has a molecular weight of 292.34 g/mol, XLogP of -0.23, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 129477089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).