N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide

C12H22N4O4 — CID 177177439

IUPACN-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
SMILESCCN(C)C(=O)CN(C)C(=O)CN(C)C(=O)CNC=O
InChIInChI=1S/C12H22N4O4/c1-5-14(2)11(19)7-16(4)12(20)8-15(3)10(18)6-13-9-17/h9H,5-8H2,1-4H3,(H,13,17)
InChIKeyRSWLVLNNWWLDLA-UHFFFAOYSA-N
MW286.33 g/mol
LogP-1.87
Rot. Bonds8

About N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide

N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide (PubChem CID 177177439) has the molecular formula C12H22N4O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide.

Molecular Properties

Compound NameN-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
PubChem CID177177439
Molecular FormulaC12H22N4O4
Molecular Weight286.33 g/mol
Exact Mass286.16
IUPAC NameN-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
SMILESCCN(C)C(=O)CN(C)C(=O)CN(C)C(=O)CNC=O
InChIInChI=1S/C12H22N4O4/c1-5-14(2)11(19)7-16(4)12(20)8-15(3)10(18)6-13-9-17/h9H,5-8H2,1-4H3,(H,13,17)
InChIKeyRSWLVLNNWWLDLA-UHFFFAOYSA-N
XLogP-1.87
TPSA90.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 5-1.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[2-[[2-[[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
CID 176672153
N-[2-[ethyl(methyl)amino]-2-oxoethyl]-N-methyl-2-(oxomethylamino)acetamide;fermium;formic acid
CID 176672168
N-ethyl-N-methyl-2-(methylamino)acetamide
CID 18683928
N-(2-aminoethyl)formamide;[ethyl(methyl)amino]methanone;N-[2-[[2-[[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-[formyl(methyl)amino]-N-methylacetamide;fermium
CID 176959908
N-methyl-2-(methylamino)-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]acetamide
CID 176959929
N-ethyl-2-[(2-ethyl-2-hydroxybutyl)amino]-N-methylacetamide
CID 65111085
N-benzyl-2-formamido-N-methylacetamide
CID 18618309
N-[2-(diethylamino)-2-oxoethyl]-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914738
2-[(2-ethoxy-2-methylpropyl)amino]-N-ethyl-N-methylacetamide
CID 114941885
2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
CID 176672127
N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide
CID 107649223
N-ethyl-N-methyl-2-[(1-propylpyrrol-2-yl)methylamino]acetamide
CID 107640510

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide?
The IUPAC name of N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide (CID 177177439) is N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide.
What is the SMILES notation for N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide?
The canonical SMILES for N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide is CCN(C)C(=O)CN(C)C(=O)CN(C)C(=O)CNC=O.
What is the InChIKey of N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide?
The InChIKey is RSWLVLNNWWLDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O4/c1-5-14(2)11(19)7-16(4)12(20)8-15(3)10(18)6-13-9-17/h9H,5-8H2,1-4H3,(H,13,17).
What are the key properties of N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide?
N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide has a molecular weight of 286.33 g/mol, XLogP of -1.87, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide is sourced from PubChem (CID 177177439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).