N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride

C14H20ClN3O2 — CID 119402184

IUPACN-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride
SMILESCCC(=O)Nc1cccc(C(=O)N2CCNCC2)c1.Cl
InChIInChI=1S/C14H19N3O2.ClH/c1-2-13(18)16-12-5-3-4-11(10-12)14(19)17-8-6-15-7-9-17;/h3-5,10,15H,2,6-9H2,1H3,(H,16,18);1H
InChIKeyGACQGSKEKUGOGX-UHFFFAOYSA-N
MW297.79 g/mol
LogP1.50
Rot. Bonds3

About N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride

N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride (PubChem CID 119402184) has the molecular formula C14H20ClN3O2 and a molecular weight of 297.79 g/mol. Its IUPAC name is N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride
PubChem CID119402184
Molecular FormulaC14H20ClN3O2
Molecular Weight297.79 g/mol
Exact Mass297.12
IUPAC NameN-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride
SMILESCCC(=O)Nc1cccc(C(=O)N2CCNCC2)c1.Cl
InChIInChI=1S/C14H19N3O2.ClH/c1-2-13(18)16-12-5-3-4-11(10-12)14(19)17-8-6-15-7-9-17;/h3-5,10,15H,2,6-9H2,1H3,(H,16,18);1H
InChIKeyGACQGSKEKUGOGX-UHFFFAOYSA-N
XLogP1.50
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(piperazine-1-carbonyl)phenyl]propanamide
CID 53215907
N-[3-[4-(ethylaminomethyl)piperidine-1-carbonyl]phenyl]propanamide
CID 119646571
N-[3-[[2-[3-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]propanamide
CID 54833152
N-[3-[(3R)-3-hydroxypyrrolidine-1-carbonyl]phenyl]propanamide
CID 111561910
[3-(piperazine-1-carbonyl)phenyl]-piperazin-1-ylmethanone
CID 54070343
N-[4-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]phenyl]propanamide
CID 54841208
N-[3-[3-(hydroxymethyl)piperidine-1-carbonyl]phenyl]propanamide
CID 110900071
N-[3-[2-(3-fluorophenyl)piperazine-1-carbonyl]phenyl]propanamide;hydrochloride
CID 120736985
2-(methylamino)-N-[3-(piperidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119740126
N-(3-acetylphenyl)propanamide
CID 903063
N-[3-(piperazine-1-carbonyl)phenyl]oxolane-2-carboxamide;hydrochloride
CID 119403639
5-methyl-1-[3-(propanoylamino)benzoyl]piperidine-3-carboxylic acid
CID 122118740

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride?
The IUPAC name of N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride (CID 119402184) is N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride.
What is the SMILES notation for N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride?
The canonical SMILES for N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride is CCC(=O)Nc1cccc(C(=O)N2CCNCC2)c1.Cl.
What is the InChIKey of N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride?
The InChIKey is GACQGSKEKUGOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2.ClH/c1-2-13(18)16-12-5-3-4-11(10-12)14(19)17-8-6-15-7-9-17;/h3-5,10,15H,2,6-9H2,1H3,(H,16,18);1H.
What are the key properties of N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride?
N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride has a molecular weight of 297.79 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride is sourced from PubChem (CID 119402184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).