N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide

C20H23N3O2 — CID 2988409

IUPACN-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H23N3O2/c1-2-19(24)21-17-10-8-16(9-11-17)20(25)23-14-12-22(13-15-23)18-6-4-3-5-7-18/h3-11H,2,12-15H2,1H3,(H,21,24)
InChIKeyXBQMKPWNPGLDDM-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.00
Rot. Bonds4

About N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide

N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide (PubChem CID 2988409) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide
PubChem CID2988409
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H23N3O2/c1-2-19(24)21-17-10-8-16(9-11-17)20(25)23-14-12-22(13-15-23)18-6-4-3-5-7-18/h3-11H,2,12-15H2,1H3,(H,21,24)
InChIKeyXBQMKPWNPGLDDM-UHFFFAOYSA-N
XLogP3.00
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]pentanamide
CID 4630313
N-phenyl-4-(4-phenylpiperazine-1-carbonyl)benzamide
CID 109048202
N-[4-(4-acetylpiperazin-1-yl)phenyl]propanamide
CID 711710
N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-phenylpropanamide
CID 1055921
N-[4-(piperazine-1-carbonyl)phenyl]propanamide
CID 53215907
ethyl 4-[[4-(4-benzoylpiperazin-1-yl)phenyl]carbamoylamino]benzoate
CID 42767164
bis[4-(4-phenylpiperazine-1-carbonyl)phenyl]methanone
CID 86192907
ethyl 4-[[3-oxo-3-(4-phenylpiperazin-1-yl)propanoyl]amino]benzoate
CID 108949464
4-(4-phenylpiperazine-1-carbonyl)-N-propan-2-ylbenzamide
CID 109043114
N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-chloro-2,2-dimethylpropanamide
CID 5224012
N-[4-(azepan-1-yl)phenyl]-2-(4-benzoylpiperazin-1-yl)acetamide
CID 9327985
N-[4-[4-(3-chlorophenyl)piperazin-1-yl]phenyl]propanamide
CID 112984512

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide?
The IUPAC name of N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide (CID 2988409) is N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide is CCC(=O)Nc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1.
What is the InChIKey of N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide?
The InChIKey is XBQMKPWNPGLDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-2-19(24)21-17-10-8-16(9-11-17)20(25)23-14-12-22(13-15-23)18-6-4-3-5-7-18/h3-11H,2,12-15H2,1H3,(H,21,24).
What are the key properties of N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide?
N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide has a molecular weight of 337.42 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 2988409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).