N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide

C15H28N4O2 — CID 120981335

IUPACN-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide
SMILESCCC(=O)NC1CCCN(CCC(=O)N2CCNCC2)C1
InChIInChI=1S/C15H28N4O2/c1-2-14(20)17-13-4-3-8-18(12-13)9-5-15(21)19-10-6-16-7-11-19/h13,16H,2-12H2,1H3,(H,17,20)
InChIKeyFSBRAOMDUXJSET-UHFFFAOYSA-N
MW296.41 g/mol
LogP-0.20
Rot. Bonds5

About N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide

N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide (PubChem CID 120981335) has the molecular formula C15H28N4O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound NameN-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide
PubChem CID120981335
Molecular FormulaC15H28N4O2
Molecular Weight296.41 g/mol
Exact Mass296.22
IUPAC NameN-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide
SMILESCCC(=O)NC1CCCN(CCC(=O)N2CCNCC2)C1
InChIInChI=1S/C15H28N4O2/c1-2-14(20)17-13-4-3-8-18(12-13)9-5-15(21)19-10-6-16-7-11-19/h13,16H,2-12H2,1H3,(H,17,20)
InChIKeyFSBRAOMDUXJSET-UHFFFAOYSA-N
XLogP-0.20
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3S)-1-[2-[(3S)-3-(propanoylamino)piperidin-1-yl]ethyl]piperidin-3-yl]propanamide
CID 96549596
3-[3-(propanoylamino)piperidin-1-yl]propanoic acid;hydrochloride
CID 71933075
3-(3-aminopiperidin-1-yl)-1-piperazin-1-ylpropan-1-one
CID 82511431
1-cyclohexyl-3-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-4-yl]urea;hydrochloride
CID 120981215
N-[1-(3-piperidin-4-ylpropanoyl)piperidin-4-yl]propanamide
CID 62210567
3-(3-methylpyrrolidin-1-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981207
1-(3-methylpiperidin-1-yl)-3-piperazin-1-ylpropan-1-one
CID 82021369
3-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-1-piperazin-1-ylpropan-1-one;dihydrochloride
CID 120982733
N-(1-methylpiperidin-3-yl)-2-piperazin-1-ylacetamide
CID 61212006
2-(1,4-diazepan-1-yl)-N-(1-methylpiperidin-3-yl)acetamide
CID 62838906
N-cyclohexyl-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 62547743
3-(2-methyl-1,4-oxazepan-4-yl)-1-piperazin-1-ylpropan-1-one
CID 55153707

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide?
The IUPAC name of N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide (CID 120981335) is N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide.
What is the SMILES notation for N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide?
The canonical SMILES for N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide is CCC(=O)NC1CCCN(CCC(=O)N2CCNCC2)C1.
What is the InChIKey of N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide?
The InChIKey is FSBRAOMDUXJSET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-2-14(20)17-13-4-3-8-18(12-13)9-5-15(21)19-10-6-16-7-11-19/h13,16H,2-12H2,1H3,(H,17,20).
What are the key properties of N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide?
N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide has a molecular weight of 296.41 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 120981335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).