N-cyclohexyl-3-piperazin-1-ylpropanamide

C13H25N3O — CID 28807752

IUPACN-cyclohexyl-3-piperazin-1-ylpropanamide
SMILESO=C(CCN1CCNCC1)NC1CCCCC1
InChIInChI=1S/C13H25N3O/c17-13(15-12-4-2-1-3-5-12)6-9-16-10-7-14-8-11-16/h12,14H,1-11H2,(H,15,17)
InChIKeyOGMPDQCCEHBAFY-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.73
Rot. Bonds4

About N-cyclohexyl-3-piperazin-1-ylpropanamide

N-cyclohexyl-3-piperazin-1-ylpropanamide (PubChem CID 28807752) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-cyclohexyl-3-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-piperazin-1-ylpropanamide
PubChem CID28807752
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-cyclohexyl-3-piperazin-1-ylpropanamide
SMILESO=C(CCN1CCNCC1)NC1CCCCC1
InChIInChI=1S/C13H25N3O/c17-13(15-12-4-2-1-3-5-12)6-9-16-10-7-14-8-11-16/h12,14H,1-11H2,(H,15,17)
InChIKeyOGMPDQCCEHBAFY-UHFFFAOYSA-N
XLogP0.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 43162430
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3-(azepan-1-yl)-N-cyclohexylpropanamide
CID 109014005
N-cyclohexyl-3-pyrrolidin-1-ylpropanamide
CID 71029146
N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide
CID 67762492
N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 60706788
N-(2-methylcyclohexyl)-3-piperazin-1-ylpropanamide
CID 66990087
1-cyclohexyl-3-(2-piperazin-1-ylethyl)urea
CID 4056008
N-cyclopropyl-3-(3-piperazin-1-ylazetidin-1-yl)propanamide
CID 66195790
1-cyclohexyl-3-[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-4-yl]urea;hydrochloride
CID 120981215
3-[4-(1-aminoethyl)piperidin-1-yl]-N-cyclohexylpropanamide
CID 63596230
N-cyclohexyl-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 62547743

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-piperazin-1-ylpropanamide?
The IUPAC name of N-cyclohexyl-3-piperazin-1-ylpropanamide (CID 28807752) is N-cyclohexyl-3-piperazin-1-ylpropanamide.
What is the SMILES notation for N-cyclohexyl-3-piperazin-1-ylpropanamide?
The canonical SMILES for N-cyclohexyl-3-piperazin-1-ylpropanamide is O=C(CCN1CCNCC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-piperazin-1-ylpropanamide?
The InChIKey is OGMPDQCCEHBAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c17-13(15-12-4-2-1-3-5-12)6-9-16-10-7-14-8-11-16/h12,14H,1-11H2,(H,15,17).
What are the key properties of N-cyclohexyl-3-piperazin-1-ylpropanamide?
N-cyclohexyl-3-piperazin-1-ylpropanamide has a molecular weight of 239.36 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-piperazin-1-ylpropanamide is sourced from PubChem (CID 28807752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).