N-cyclohexyl-3-piperazin-1-ylbenzamide

C17H25N3O — CID 28748940

IUPACN-cyclohexyl-3-piperazin-1-ylbenzamide
SMILESO=C(NC1CCCCC1)c1cccc(N2CCNCC2)c1
InChIInChI=1S/C17H25N3O/c21-17(19-15-6-2-1-3-7-15)14-5-4-8-16(13-14)20-11-9-18-10-12-20/h4-5,8,13,15,18H,1-3,6-7,9-12H2,(H,19,21)
InChIKeyRWAPDMFHMATZJB-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.16
Rot. Bonds3

About N-cyclohexyl-3-piperazin-1-ylbenzamide

N-cyclohexyl-3-piperazin-1-ylbenzamide (PubChem CID 28748940) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-cyclohexyl-3-piperazin-1-ylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-3-piperazin-1-ylbenzamide
PubChem CID28748940
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-cyclohexyl-3-piperazin-1-ylbenzamide
SMILESO=C(NC1CCCCC1)c1cccc(N2CCNCC2)c1
InChIInChI=1S/C17H25N3O/c21-17(19-15-6-2-1-3-7-15)14-5-4-8-16(13-14)20-11-9-18-10-12-20/h4-5,8,13,15,18H,1-3,6-7,9-12H2,(H,19,21)
InChIKeyRWAPDMFHMATZJB-UHFFFAOYSA-N
XLogP2.16
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-3-(4-phenylpiperazine-1-carbonyl)benzamide
CID 109052171
N-cyclooctyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 4229482
(3-piperazin-1-ylphenyl)-piperidin-1-ylmethanone
CID 28748938
6-(azonan-1-yl)-N-[(3R)-pyrrolidin-3-yl]cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
CID 139502337
N-cycloheptyl-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051684
N-cyclooctyl-3-methylbenzamide
CID 966011
N-cyclohexyl-3-piperidin-3-ylbenzamide;hydrochloride
CID 172654417
N-cyclohexyl-3-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzamide
CID 20898578
methyl 3-[4-(cycloheptylcarbamoyl)piperazin-1-yl]benzoate
CID 113110616
3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-piperidin-3-ylbenzamide
CID 119428215
N-[1-(1-phenylethyl)piperidin-4-yl]-3-pyrrolidin-1-ylbenzamide
CID 138058182
3-methyl-N-(1-phenylpiperidin-4-yl)benzamide
CID 110735842

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-piperazin-1-ylbenzamide?
The IUPAC name of N-cyclohexyl-3-piperazin-1-ylbenzamide (CID 28748940) is N-cyclohexyl-3-piperazin-1-ylbenzamide.
What is the SMILES notation for N-cyclohexyl-3-piperazin-1-ylbenzamide?
The canonical SMILES for N-cyclohexyl-3-piperazin-1-ylbenzamide is O=C(NC1CCCCC1)c1cccc(N2CCNCC2)c1.
What is the InChIKey of N-cyclohexyl-3-piperazin-1-ylbenzamide?
The InChIKey is RWAPDMFHMATZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c21-17(19-15-6-2-1-3-7-15)14-5-4-8-16(13-14)20-11-9-18-10-12-20/h4-5,8,13,15,18H,1-3,6-7,9-12H2,(H,19,21).
What are the key properties of N-cyclohexyl-3-piperazin-1-ylbenzamide?
N-cyclohexyl-3-piperazin-1-ylbenzamide has a molecular weight of 287.41 g/mol, XLogP of 2.16, 3 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-ylbenzamide is sourced from PubChem (CID 28748940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).