N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide

C11H23N3O2 — CID 28807760

IUPACN-(3-methoxypropyl)-3-piperazin-1-ylpropanamide
SMILESCOCCCNC(=O)CCN1CCNCC1
InChIInChI=1S/C11H23N3O2/c1-16-10-2-4-13-11(15)3-7-14-8-5-12-6-9-14/h12H,2-10H2,1H3,(H,13,15)
InChIKeyVZKFVARFWQCXKZ-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.57
Rot. Bonds7

About N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide

N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide (PubChem CID 28807760) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-3-piperazin-1-ylpropanamide
PubChem CID28807760
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN-(3-methoxypropyl)-3-piperazin-1-ylpropanamide
SMILESCOCCCNC(=O)CCN1CCNCC1
InChIInChI=1S/C11H23N3O2/c1-16-10-2-4-13-11(15)3-7-14-8-5-12-6-9-14/h12H,2-10H2,1H3,(H,13,15)
InChIKeyVZKFVARFWQCXKZ-UHFFFAOYSA-N
XLogP-0.57
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide 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

5,5-dimethyl-N-(3-piperazin-1-ylpropyl)hexanamide
CID 119394555
N-(2-piperazin-1-ylethyl)-3-propan-2-yloxypropanamide;hydrochloride
CID 119445635
3-(4-acetylpiperazin-1-yl)-N-(2-methoxyethyl)propanamide
CID 109014994
2-methoxy-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119446588
N-[2-oxo-2-(3-piperazin-1-ylpropylamino)ethyl]butanamide
CID 119393390
ethane;4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]butanamide
CID 170620948
2,2-dimethyl-N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]propanamide
CID 119391257
3-(1,4-diazepan-1-yl)-N-ethylpropanamide
CID 62324150
N-(3-piperazin-1-ylpropyl)pent-4-enamide
CID 62679296
N-(2-piperazin-1-ylethyl)-4-prop-2-enoxybutanamide
CID 119447035
3-methyl-N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]butanamide;hydrochloride
CID 119390933
3-(3,5-dimethylphenoxy)-N-(3-piperazin-1-ylpropyl)propanamide;hydrochloride
CID 119393354

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide?
The IUPAC name of N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide (CID 28807760) is N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide.
What is the SMILES notation for N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide?
The canonical SMILES for N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide is COCCCNC(=O)CCN1CCNCC1.
What is the InChIKey of N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide?
The InChIKey is VZKFVARFWQCXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-16-10-2-4-13-11(15)3-7-14-8-5-12-6-9-14/h12H,2-10H2,1H3,(H,13,15).
What are the key properties of N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide?
N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide has a molecular weight of 229.32 g/mol, XLogP of -0.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-3-piperazin-1-ylpropanamide is sourced from PubChem (CID 28807760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).