N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide

C10H23N3O — CID 59112854

IUPACN-[3-[3-aminopropyl(methyl)amino]propyl]propanamide
SMILESCCC(=O)NCCCN(C)CCCN
InChIInChI=1S/C10H23N3O/c1-3-10(14)12-7-5-9-13(2)8-4-6-11/h3-9,11H2,1-2H3,(H,12,14)
InChIKeyXKQVMLNSTZKRQD-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.18
Rot. Bonds8

About N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide

N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide (PubChem CID 59112854) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide.

Molecular Properties

Compound NameN-[3-[3-aminopropyl(methyl)amino]propyl]propanamide
PubChem CID59112854
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC NameN-[3-[3-aminopropyl(methyl)amino]propyl]propanamide
SMILESCCC(=O)NCCCN(C)CCCN
InChIInChI=1S/C10H23N3O/c1-3-10(14)12-7-5-9-13(2)8-4-6-11/h3-9,11H2,1-2H3,(H,12,14)
InChIKeyXKQVMLNSTZKRQD-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[3-[3-aminopropyl(methyl)amino]propyl]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

N-(3-aminopropyl)propanamide
CID 21290277
N-[3-[3-aminopropyl(methyl)amino]propyl]acetamide
CID 59112836
3-[3-aminopropyl(methyl)amino]-N-[3-(methylamino)propyl]propanamide
CID 102040289
5-amino-N-[5-(propanoylamino)pentyl]pentanamide
CID 170966361
2-hydroxy-N-[3-[2-hydroxyethyl(methyl)amino]propyl]acetamide
CID 20627469
3-[2-aminoethyl(methyl)amino]-N-tridecylpropanamide
CID 58105615
2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride
CID 119855427
3-[3-aminopropyl(methyl)amino]propan-1-ol
CID 45088131
N'-methyl-N'-[2-[methyl-[2-[methyl-[3-(methylamino)propyl]amino]ethyl]amino]ethyl]propane-1,3-diamine
CID 156899705
N'-[3-[3-aminopropyl(methyl)amino]propyl]butane-1,4-diamine
CID 71344458
N-[3-[2-hydroxyethyl(methyl)amino]propyl]pentadecanamide
CID 102462917
3-[butyl(methyl)amino]-N-(5-hydroxypentyl)propanamide
CID 108795355

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide?
The IUPAC name of N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide (CID 59112854) is N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide.
What is the SMILES notation for N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide?
The canonical SMILES for N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide is CCC(=O)NCCCN(C)CCCN.
What is the InChIKey of N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide?
The InChIKey is XKQVMLNSTZKRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-3-10(14)12-7-5-9-13(2)8-4-6-11/h3-9,11H2,1-2H3,(H,12,14).
What are the key properties of N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide?
N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide has a molecular weight of 201.31 g/mol, XLogP of 0.18, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide is sourced from PubChem (CID 59112854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).