N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide

C15H23N3O2 — CID 61237892

IUPACN-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide
SMILESCC(C(=O)Nc1ccc(CCO)cc1)N1CCNCC1
InChIInChI=1S/C15H23N3O2/c1-12(18-9-7-16-8-10-18)15(20)17-14-4-2-13(3-5-14)6-11-19/h2-5,12,16,19H,6-11H2,1H3,(H,17,20)
InChIKeyLLINKMLKLUEKFJ-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.45
Rot. Bonds5

About N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide

N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide (PubChem CID 61237892) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide
PubChem CID61237892
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide
SMILESCC(C(=O)Nc1ccc(CCO)cc1)N1CCNCC1
InChIInChI=1S/C15H23N3O2/c1-12(18-9-7-16-8-10-18)15(20)17-14-4-2-13(3-5-14)6-11-19/h2-5,12,16,19H,6-11H2,1H3,(H,17,20)
InChIKeyLLINKMLKLUEKFJ-UHFFFAOYSA-N
XLogP0.45
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-2-piperazin-1-ylpropanamide
CID 43089583
N-(4-aminophenyl)-2-piperazin-1-ylpropanamide
CID 82224554
N-(4-bromophenyl)-2-piperazin-1-ylpropanamide
CID 43089557
N-(4-methylsulfonylphenyl)-2-piperazin-1-ylpropanamide
CID 43130677
(2R)-2-piperazin-1-yl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 172616564
N-[2-(4-methoxyphenyl)ethyl]-2-piperazin-1-ylpropanamide
CID 43130632
(2S)-N-(3-fluorophenyl)-2-piperazin-1-ylpropanamide
CID 28507016
2-piperazin-1-yl-N-[6-(trifluoromethyl)-3-pyridinyl]propanamide
CID 82795400
3-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62838562
N-[4-(2-hydroxyethyl)phenyl]-2-methyl-3-methylsulfanylpropanamide
CID 75381692
N-[4-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)propanamide
CID 16789447
N-naphthalen-1-yl-2-piperazin-1-ylpropanamide
CID 43089580

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide?
The IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide (CID 61237892) is N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide is CC(C(=O)Nc1ccc(CCO)cc1)N1CCNCC1.
What is the InChIKey of N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide?
The InChIKey is LLINKMLKLUEKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(18-9-7-16-8-10-18)15(20)17-14-4-2-13(3-5-14)6-11-19/h2-5,12,16,19H,6-11H2,1H3,(H,17,20).
What are the key properties of N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide?
N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 0.45, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyethyl)phenyl]-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 61237892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).