2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide

C17H27N3O — CID 119445557

IUPAC2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide
SMILESCCCC(C(=O)NCCN1CCNCC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-2-6-16(15-7-4-3-5-8-15)17(21)19-11-14-20-12-9-18-10-13-20/h3-5,7-8,16,18H,2,6,9-14H2,1H3,(H,19,21)
InChIKeyNVZUGMOURZUCKP-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.59
Rot. Bonds7

About 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide

2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide (PubChem CID 119445557) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide.

Molecular Properties

Compound Name2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide
PubChem CID119445557
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide
SMILESCCCC(C(=O)NCCN1CCNCC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-2-6-16(15-7-4-3-5-8-15)17(21)19-11-14-20-12-9-18-10-13-20/h3-5,7-8,16,18H,2,6,9-14H2,1H3,(H,19,21)
InChIKeyNVZUGMOURZUCKP-UHFFFAOYSA-N
XLogP1.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-phenylpentanamide
CID 134014925
2-(2-ethylphenoxy)-2-phenyl-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119448091
3-amino-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 62878557
2-(diethylamino)-2-phenyl-N-(3-piperazin-1-ylpropyl)acetamide
CID 119392036
3-methyl-2-phenyl-N-(3-piperazin-1-ylpropyl)butanamide;hydrochloride
CID 119391045
(3R)-3-(2-chlorophenyl)-3-phenyl-N-(2-piperazin-1-ylethyl)propanamide
CID 97283785
2-benzylsulfanyl-3-methyl-N-(2-piperazin-1-ylethyl)butanamide
CID 119447080
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylpentanamide
CID 134049550
3-phenyl-N-(3-piperazin-1-ylpropyl)pentanamide
CID 119394066
5-oxo-1-(1-phenylethyl)-N-(2-piperazin-1-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119444737
(2S)-3-(4-hydroxyphenyl)-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 97445107
N-[2-oxo-1-phenyl-2-(3-piperazin-1-ylpropylamino)ethyl]benzamide;hydrochloride
CID 119390719

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide?
The IUPAC name of 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide (CID 119445557) is 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide.
What is the SMILES notation for 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide?
The canonical SMILES for 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide is CCCC(C(=O)NCCN1CCNCC1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide?
The InChIKey is NVZUGMOURZUCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-6-16(15-7-4-3-5-8-15)17(21)19-11-14-20-12-9-18-10-13-20/h3-5,7-8,16,18H,2,6,9-14H2,1H3,(H,19,21).
What are the key properties of 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide?
2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide has a molecular weight of 289.42 g/mol, XLogP of 1.59, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-piperazin-1-ylethyl)pentanamide is sourced from PubChem (CID 119445557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).