2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide

C15H32N4O3 — CID 176576928

IUPAC2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide
SMILESCC(C)NCCNC(=O)CNCCOCCNC(=O)C(C)C
InChIInChI=1S/C15H32N4O3/c1-12(2)15(21)19-8-10-22-9-7-16-11-14(20)18-6-5-17-13(3)4/h12-13,16-17H,5-11H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyRVBFZHOIZWNGME-UHFFFAOYSA-N
MW316.45 g/mol
LogP-0.52
Rot. Bonds13

About 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide

2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide (PubChem CID 176576928) has the molecular formula C15H32N4O3 and a molecular weight of 316.45 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide
PubChem CID176576928
Molecular FormulaC15H32N4O3
Molecular Weight316.45 g/mol
Exact Mass316.25
IUPAC Name2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide
SMILESCC(C)NCCNC(=O)CNCCOCCNC(=O)C(C)C
InChIInChI=1S/C15H32N4O3/c1-12(2)15(21)19-8-10-22-9-7-16-11-14(20)18-6-5-17-13(3)4/h12-13,16-17H,5-11H2,1-4H3,(H,18,20)(H,19,21)
InChIKeyRVBFZHOIZWNGME-UHFFFAOYSA-N
XLogP-0.52
TPSA91.49 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 5-0.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727258
2-methyl-N-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727326
ethane;2-methyl-N-[2-[2-[2-[2-[2-[2-[2-[2-[[2-(methylamino)acetyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 145320250
3-methyl-N-[2-[2-[2-[2-[2-(2-methylpropanoylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 129177570
N-[2-[2-(ethylamino)ethoxy]ethyl]-2-methylpropanamide;molecular hydrogen
CID 172574109
N-(2-methoxyethyl)-2-(2-propoxyethylamino)acetamide
CID 106452448
4-methyl-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 171803932
N-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethyl]-2-methylpropanamide
CID 155402187
1-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethylamino]butan-2-one
CID 176580900
3,3-dimethyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]butanamide
CID 135224068
2-methyl-N-[2-[2-[2-(3-tritiopropanoylamino)ethoxy]ethoxy]ethyl]propanamide
CID 159896398
N-[2-[2-[2-[3-oxo-3-[2-(propan-2-ylamino)ethylamino]propoxy]ethoxy]ethoxy]ethyl]-3-sulfanylbutanamide
CID 167310634

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide?
The IUPAC name of 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide (CID 176576928) is 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide is CC(C)NCCNC(=O)CNCCOCCNC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide?
The InChIKey is RVBFZHOIZWNGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O3/c1-12(2)15(21)19-8-10-22-9-7-16-11-14(20)18-6-5-17-13(3)4/h12-13,16-17H,5-11H2,1-4H3,(H,18,20)(H,19,21).
What are the key properties of 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide?
2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide has a molecular weight of 316.45 g/mol, XLogP of -0.52, 13 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-[[2-oxo-2-[2-(propan-2-ylamino)ethylamino]ethyl]amino]ethoxy]ethyl]propanamide is sourced from PubChem (CID 176576928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).