N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide

C24H33N3O — CID 3060009

IUPACN-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide
SMILESCCC(=O)N(c1ccccc1)C(C)CN1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H33N3O/c1-3-24(28)27(23-12-8-5-9-13-23)21(2)20-26-18-16-25(17-19-26)15-14-22-10-6-4-7-11-22/h4-13,21H,3,14-20H2,1-2H3
InChIKeyQSZXXMXZCPVCCT-UHFFFAOYSA-N
MW379.55 g/mol
LogP3.68
Rot. Bonds8

About N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide

N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide (PubChem CID 3060009) has the molecular formula C24H33N3O and a molecular weight of 379.55 g/mol. Its IUPAC name is N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide.

Molecular Properties

Compound NameN-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide
PubChem CID3060009
Molecular FormulaC24H33N3O
Molecular Weight379.55 g/mol
Exact Mass379.26
IUPAC NameN-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide
SMILESCCC(=O)N(c1ccccc1)C(C)CN1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H33N3O/c1-3-24(28)27(23-12-8-5-9-13-23)21(2)20-26-18-16-25(17-19-26)15-14-22-10-6-4-7-11-22/h4-13,21H,3,14-20H2,1-2H3
InChIKeyQSZXXMXZCPVCCT-UHFFFAOYSA-N
XLogP3.68
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.55
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 3345
ethane;N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 160668171
bis(N-[1-(4-hydroxy-4-phenylpiperidin-1-yl)propan-2-yl]-N-phenylpropanamide);oxalic acid
CID 3048542
N-[2-methyl-2-[4-(2-phenylethyl)piperazin-1-yl]propyl]-N-phenylpropanamide
CID 126539567
1,1-diethoxyethane;N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 166758697
2-[4-(2-phenylethyl)piperazin-1-yl]-N,N-dipropylacetamide
CID 52553124
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide azide
CID 126650510
N-[4-[methyl(2-phenylethyl)amino]butan-2-yl]-N-phenylpropanamide
CID 11724725
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide sulfate
CID 53341505
but-2-enedioic acid;N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 68613507
2,2,3,3,3-pentadeuterio-N-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide;hydrochloride
CID 71751493
N-phenyl-N-[2-[3-(2-phenylethyl)-1,3-diazinan-1-yl]ethyl]propanamide
CID 3060235

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide?
The IUPAC name of N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide (CID 3060009) is N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide.
What is the SMILES notation for N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide?
The canonical SMILES for N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide is CCC(=O)N(c1ccccc1)C(C)CN1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide?
The InChIKey is QSZXXMXZCPVCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O/c1-3-24(28)27(23-12-8-5-9-13-23)21(2)20-26-18-16-25(17-19-26)15-14-22-10-6-4-7-11-22/h4-13,21H,3,14-20H2,1-2H3.
What are the key properties of N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide?
N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide has a molecular weight of 379.55 g/mol, XLogP of 3.68, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]propanamide is sourced from PubChem (CID 3060009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).