N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide

C19H24N4O — CID 109030344

IUPACN-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SMILESCc1ccc(NC(=O)CCN2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C19H24N4O/c1-16-5-7-17(8-6-16)21-19(24)9-11-22-12-14-23(15-13-22)18-4-2-3-10-20-18/h2-8,10H,9,11-15H2,1H3,(H,21,24)
InChIKeyTVEQYGQRRRNIER-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.54
Rot. Bonds5

About N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide

N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide (PubChem CID 109030344) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
PubChem CID109030344
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SMILESCc1ccc(NC(=O)CCN2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C19H24N4O/c1-16-5-7-17(8-6-16)21-19(24)9-11-22-12-14-23(15-13-22)18-4-2-3-10-20-18/h2-8,10H,9,11-15H2,1H3,(H,21,24)
InChIKeyTVEQYGQRRRNIER-UHFFFAOYSA-N
XLogP2.54
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(dimethylamino)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 6259677
N-(4-methylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661863
N-(1,3-benzodioxol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 13210213
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 109004730
N-(9-ethylcarbazol-3-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 22458846
N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 71867008
N-(4-methylphenyl)-3-(4-methylpiperazin-1-yl)propanamide;dihydrochloride
CID 19661853
N-[2-(ethylaminomethyl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 119438834
N-(3-fluoro-4-methylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4566699
oxalic acid;N-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)butanoyl]phenyl]acetamide
CID 164628176
3-(4-pyridin-2-ylpiperazin-1-yl)propanamide;dihydrochloride
CID 11971564
N-(4-methylphenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide chloride
CID 53312696

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide (CID 109030344) is N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide is Cc1ccc(NC(=O)CCN2CCN(c3ccccn3)CC2)cc1.
What is the InChIKey of N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The InChIKey is TVEQYGQRRRNIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-16-5-7-17(8-6-16)21-19(24)9-11-22-12-14-23(15-13-22)18-4-2-3-10-20-18/h2-8,10H,9,11-15H2,1H3,(H,21,24).
What are the key properties of N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide has a molecular weight of 324.43 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 109030344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).