2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide

C11H25N3O — CID 62642701

IUPAC2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
SMILESCCCNC(=O)CNCCN(C)C(C)C
InChIInChI=1S/C11H25N3O/c1-5-6-13-11(15)9-12-7-8-14(4)10(2)3/h10,12H,5-9H2,1-4H3,(H,13,15)
InChIKeyHICALRZTNLMDMR-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.44
Rot. Bonds8

About 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide

2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide (PubChem CID 62642701) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide.

Molecular Properties

Compound Name2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
PubChem CID62642701
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
SMILESCCCNC(=O)CNCCN(C)C(C)C
InChIInChI=1S/C11H25N3O/c1-5-6-13-11(15)9-12-7-8-14(4)10(2)3/h10,12H,5-9H2,1-4H3,(H,13,15)
InChIKeyHICALRZTNLMDMR-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide 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

N-(2-cyanoethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide
CID 62640317
3-[methyl(propan-2-yl)amino]-N-propylpropanamide
CID 170366588
N-butyl-2-[2-[di(propan-2-yl)amino]ethylamino]acetamide
CID 60672606
2-(3-methylbutylamino)-N-propylacetamide
CID 28576469
N-ethyl-N-methyl-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide
CID 62639952
N,N-dimethyl-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide;ethane
CID 170647127
2-[[(2S)-2-hydroxypropyl]amino]-N-propylacetamide
CID 106931868
2-(5-methylhexylamino)-N-propylacetamide
CID 115325791
N-methyl-2-[3-[methyl(propan-2-yl)amino]propylamino]acetamide
CID 106045584
tert-butyl 2-[2-[methyl(propan-2-yl)amino]ethylamino]acetate
CID 62641218
ethyl 2-[[2-[methyl(propan-2-yl)amino]ethylamino]methyl]prop-2-enoate
CID 103249346
N-(4-fluorophenyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide
CID 62642513

Frequently Asked Questions

What is the IUPAC name of 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide?
The IUPAC name of 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide (CID 62642701) is 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide.
What is the SMILES notation for 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide?
The canonical SMILES for 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide is CCCNC(=O)CNCCN(C)C(C)C.
What is the InChIKey of 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide?
The InChIKey is HICALRZTNLMDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-5-6-13-11(15)9-12-7-8-14(4)10(2)3/h10,12H,5-9H2,1-4H3,(H,13,15).
What are the key properties of 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide?
2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide has a molecular weight of 215.34 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide is sourced from PubChem (CID 62642701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).