3-(4-methylpiperazin-1-yl)-N-propylpropanamide

C11H23N3O — CID 109011333

IUPAC3-(4-methylpiperazin-1-yl)-N-propylpropanamide
SMILESCCCNC(=O)CCN1CCN(C)CC1
InChIInChI=1S/C11H23N3O/c1-3-5-12-11(15)4-6-14-9-7-13(2)8-10-14/h3-10H2,1-2H3,(H,12,15)
InChIKeyKPYSUAXPFJKLMX-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.15
Rot. Bonds5

About 3-(4-methylpiperazin-1-yl)-N-propylpropanamide

3-(4-methylpiperazin-1-yl)-N-propylpropanamide (PubChem CID 109011333) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-(4-methylpiperazin-1-yl)-N-propylpropanamide.

Molecular Properties

Compound Name3-(4-methylpiperazin-1-yl)-N-propylpropanamide
PubChem CID109011333
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-(4-methylpiperazin-1-yl)-N-propylpropanamide
SMILESCCCNC(=O)CCN1CCN(C)CC1
InChIInChI=1S/C11H23N3O/c1-3-5-12-11(15)4-6-14-9-7-13(2)8-10-14/h3-10H2,1-2H3,(H,12,15)
InChIKeyKPYSUAXPFJKLMX-UHFFFAOYSA-N
XLogP0.15
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-3-(4-methylpiperazin-1-yl)propanamide
CID 109012187
ethane;5-(4-methylpiperazin-1-yl)-N-propylpentanamide
CID 176967624
3-(4-acetylpiperazin-1-yl)-N-propylpropanamide
CID 109011336
3-piperidin-1-yl-N-propylpropanamide
CID 110688262
N-butyl-3-(4-ethylpiperazin-1-yl)propanamide
CID 109012188
3-(4-methylpiperazin-1-yl)-N-[10-(4-methylpiperazin-1-yl)-8-oxodecyl]propanamide
CID 165060852
CID 58998076
CID 58998076
N-[2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]ethyl]butanamide;molecular hydrogen
CID 155582806
ethyl 4-[3-(butylamino)-3-oxopropyl]piperazine-1-carboxylate
CID 109012229
3-(4-formylpiperazin-1-yl)-N-pentylpropanamide
CID 109017998
3-[2-(4-methylpiperazin-1-yl)ethylamino]-3-oxopropanoic acid
CID 62230217
2-(methylamino)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
CID 60925043

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylpiperazin-1-yl)-N-propylpropanamide?
The IUPAC name of 3-(4-methylpiperazin-1-yl)-N-propylpropanamide (CID 109011333) is 3-(4-methylpiperazin-1-yl)-N-propylpropanamide.
What is the SMILES notation for 3-(4-methylpiperazin-1-yl)-N-propylpropanamide?
The canonical SMILES for 3-(4-methylpiperazin-1-yl)-N-propylpropanamide is CCCNC(=O)CCN1CCN(C)CC1.
What is the InChIKey of 3-(4-methylpiperazin-1-yl)-N-propylpropanamide?
The InChIKey is KPYSUAXPFJKLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-3-5-12-11(15)4-6-14-9-7-13(2)8-10-14/h3-10H2,1-2H3,(H,12,15).
What are the key properties of 3-(4-methylpiperazin-1-yl)-N-propylpropanamide?
3-(4-methylpiperazin-1-yl)-N-propylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylpiperazin-1-yl)-N-propylpropanamide is sourced from PubChem (CID 109011333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).