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

C14H19N3O2 — CID 53215907

IUPACN-[4-(piperazine-1-carbonyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCNCC2)cc1
InChIInChI=1S/C14H19N3O2/c1-2-13(18)16-12-5-3-11(4-6-12)14(19)17-9-7-15-8-10-17/h3-6,15H,2,7-10H2,1H3,(H,16,18)
InChIKeyDEUOGRNXLHKJLH-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.08
Rot. Bonds3

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

N-[4-(piperazine-1-carbonyl)phenyl]propanamide (PubChem CID 53215907) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[4-(piperazine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(piperazine-1-carbonyl)phenyl]propanamide
PubChem CID53215907
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-[4-(piperazine-1-carbonyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCNCC2)cc1
InChIInChI=1S/C14H19N3O2/c1-2-13(18)16-12-5-3-11(4-6-12)14(19)17-9-7-15-8-10-17/h3-6,15H,2,7-10H2,1H3,(H,16,18)
InChIKeyDEUOGRNXLHKJLH-UHFFFAOYSA-N
XLogP1.08
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(piperazine-1-carbonyl)phenyl]propanamide;hydrochloride
CID 119402184
N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]propanamide
CID 2988409
N-methyl-1-[4-(propanoylamino)benzoyl]piperidine-4-carboxamide
CID 20973011
N-[4-(piperazine-1-carbonyl)phenyl]propane-1-sulfonamide;hydrochloride
CID 119401361
N-[4-(1,4-diazepane-1-carbonyl)phenyl]cyclopropanecarboxamide;hydrochloride
CID 119418264
1-[4-(piperazine-1-carbonyl)phenyl]ethanone
CID 82510195
N-[4-(1,4-dimethyl-1,4,9-triazaspiro[5.5]undecane-9-carbonyl)phenyl]propanamide
CID 56752137
2,2-diphenyl-N-[4-(piperazine-1-carbonyl)phenyl]acetamide
CID 70153616
N-[[4-(piperidine-1-carbonyl)phenyl]carbamothioyl]propanamide
CID 26168019
N-[4-(1,4-diazepane-1-carbonyl)phenyl]benzamide;hydrochloride
CID 119417229
ethane;phenyl(piperazin-1-yl)methanone
CID 91566193
N-(4-ethylphenyl)-5-[4-(piperazine-1-carbonyl)phenyl]pyridine-3-carboxamide
CID 164524545

Frequently Asked Questions

What is the IUPAC name of N-[4-(piperazine-1-carbonyl)phenyl]propanamide?
The IUPAC name of N-[4-(piperazine-1-carbonyl)phenyl]propanamide (CID 53215907) is N-[4-(piperazine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(piperazine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for N-[4-(piperazine-1-carbonyl)phenyl]propanamide is CCC(=O)Nc1ccc(C(=O)N2CCNCC2)cc1.
What is the InChIKey of N-[4-(piperazine-1-carbonyl)phenyl]propanamide?
The InChIKey is DEUOGRNXLHKJLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-2-13(18)16-12-5-3-11(4-6-12)14(19)17-9-7-15-8-10-17/h3-6,15H,2,7-10H2,1H3,(H,16,18).
What are the key properties of N-[4-(piperazine-1-carbonyl)phenyl]propanamide?
N-[4-(piperazine-1-carbonyl)phenyl]propanamide has a molecular weight of 261.32 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(piperazine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 53215907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).