5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide

C19H24N4O — CID 109179090

IUPAC5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1ccc(N2CCN(c3ccccc3)CC2)cn1
InChIInChI=1S/C19H24N4O/c1-2-10-20-19(24)18-9-8-17(15-21-18)23-13-11-22(12-14-23)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,24)
InChIKeyDKBSRVQDQSSUDA-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.55
Rot. Bonds5

About 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide

5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide (PubChem CID 109179090) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide
PubChem CID109179090
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1ccc(N2CCN(c3ccccc3)CC2)cn1
InChIInChI=1S/C19H24N4O/c1-2-10-20-19(24)18-9-8-17(15-21-18)23-13-11-22(12-14-23)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,24)
InChIKeyDKBSRVQDQSSUDA-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propylpyridine-2-carboxamide
CID 109179080
N-[(2-methylphenyl)methyl]-5-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109188154
5-(4-methylpiperazin-1-yl)-N-pentylpyridine-2-carboxamide
CID 109186486
5-[4-(4-methylpiperazin-1-yl)anilino]-N-propylpyridine-2-carboxamide
CID 109179197
5-(4-phenylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109190892
5-(4-benzylpiperidin-1-yl)-N-butylpyridine-2-carboxamide
CID 109180700
ethyl 4-[6-(2-phenylethylcarbamoyl)-3-pyridinyl]piperazine-1-carboxylate
CID 109191756
1-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]ethanone
CID 83120198
N-benzyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 109187850
5-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183865
5-(4-acetylpiperazin-1-yl)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109187365
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide
CID 109194312

Frequently Asked Questions

What is the IUPAC name of 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide?
The IUPAC name of 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide (CID 109179090) is 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide.
What is the SMILES notation for 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide?
The canonical SMILES for 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide is CCCNC(=O)c1ccc(N2CCN(c3ccccc3)CC2)cn1.
What is the InChIKey of 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide?
The InChIKey is DKBSRVQDQSSUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-2-10-20-19(24)18-9-8-17(15-21-18)23-13-11-22(12-14-23)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,24).
What are the key properties of 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide?
5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-phenylpiperazin-1-yl)-N-propylpyridine-2-carboxamide is sourced from PubChem (CID 109179090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).