N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide

C23H24N4O2 — CID 109215246

IUPACN-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(N3CCN(c4ccccc4)CC3)ccn2)cc1
InChIInChI=1S/C23H24N4O2/c1-29-21-9-7-18(8-10-21)25-23(28)22-17-20(11-12-24-22)27-15-13-26(14-16-27)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,28)
InChIKeyYRHGOAJMUQJWPI-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.67
Rot. Bonds5

About N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide

N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide (PubChem CID 109215246) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
PubChem CID109215246
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(N3CCN(c4ccccc4)CC3)ccn2)cc1
InChIInChI=1S/C23H24N4O2/c1-29-21-9-7-18(8-10-21)25-23(28)22-17-20(11-12-24-22)27-15-13-26(14-16-27)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,28)
InChIKeyYRHGOAJMUQJWPI-UHFFFAOYSA-N
XLogP3.67
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109215237
4-methoxy-N-[4-(4-phenylpiperazin-1-yl)phenyl]benzamide
CID 112983942
N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203921
4-(4-formylpiperazin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109208961
ethyl 4-[2-(phenylcarbamoyl)-4-pyridinyl]piperazine-1-carboxylate
CID 109215966
4-(4-methylpiperazin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
CID 109208359
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
N-(4-ethoxyphenyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204671
4-(azepan-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109218677
5-methoxy-N-[4-(4-pyridin-3-ylpiperazin-1-yl)phenyl]pyridine-2-carboxamide
CID 142608158
N-(4-acetamidophenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203936
4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109206099

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide (CID 109215246) is N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2cc(N3CCN(c4ccccc4)CC3)ccn2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The InChIKey is YRHGOAJMUQJWPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-29-21-9-7-18(8-10-21)25-23(28)22-17-20(11-12-24-22)27-15-13-26(14-16-27)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,25,28).
What are the key properties of N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109215246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).