2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide

C15H28N4O6 — CID 123313081

IUPAC2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide
SMILESCC(C)(CC(C)(C)NC(=O)COCC(N)=O)NC(=O)COCC(N)=O
InChIInChI=1S/C15H28N4O6/c1-14(2,18-12(22)7-24-5-10(16)20)9-15(3,4)19-13(23)8-25-6-11(17)21/h5-9H2,1-4H3,(H2,16,20)(H2,17,21)(H,18,22)(H,19,23)
InChIKeySBTZBTUZCMYMCS-UHFFFAOYSA-N
MW360.41 g/mol
LogP-1.83
Rot. Bonds12

About 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide

2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide (PubChem CID 123313081) has the molecular formula C15H28N4O6 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide
PubChem CID123313081
Molecular FormulaC15H28N4O6
Molecular Weight360.41 g/mol
Exact Mass360.20
IUPAC Name2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide
SMILESCC(C)(CC(C)(C)NC(=O)COCC(N)=O)NC(=O)COCC(N)=O
InChIInChI=1S/C15H28N4O6/c1-14(2,18-12(22)7-24-5-10(16)20)9-15(3,4)19-13(23)8-25-6-11(17)21/h5-9H2,1-4H3,(H2,16,20)(H2,17,21)(H,18,22)(H,19,23)
InChIKeySBTZBTUZCMYMCS-UHFFFAOYSA-N
XLogP-1.83
TPSA162.84 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 5-1.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide?
The IUPAC name of 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide (CID 123313081) is 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide.
What is the SMILES notation for 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide?
The canonical SMILES for 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide is CC(C)(CC(C)(C)NC(=O)COCC(N)=O)NC(=O)COCC(N)=O.
What is the InChIKey of 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide?
The InChIKey is SBTZBTUZCMYMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O6/c1-14(2,18-12(22)7-24-5-10(16)20)9-15(3,4)19-13(23)8-25-6-11(17)21/h5-9H2,1-4H3,(H2,16,20)(H2,17,21)(H,18,22)(H,19,23).
What are the key properties of 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide?
2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide has a molecular weight of 360.41 g/mol, XLogP of -1.83, 12 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[4-[[2-(2-amino-2-oxoethoxy)acetyl]amino]-2,4-dimethylpentan-2-yl]amino]-2-oxoethoxy]acetamide is sourced from PubChem (CID 123313081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).