4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide

C22H30N4O2 — CID 109216074

IUPAC4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1cc(N2CCN(c3ccccc3OC)CC2)ccn1
InChIInChI=1S/C22H30N4O2/c1-3-4-7-11-24-22(27)19-17-18(10-12-23-19)25-13-15-26(16-14-25)20-8-5-6-9-21(20)28-2/h5-6,8-10,12,17H,3-4,7,11,13-16H2,1-2H3,(H,24,27)
InChIKeyZNFINDASLOUTIC-UHFFFAOYSA-N
MW382.51 g/mol
LogP3.34
Rot. Bonds8

About 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide

4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide (PubChem CID 109216074) has the molecular formula C22H30N4O2 and a molecular weight of 382.51 g/mol. Its IUPAC name is 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide
PubChem CID109216074
Molecular FormulaC22H30N4O2
Molecular Weight382.51 g/mol
Exact Mass382.24
IUPAC Name4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1cc(N2CCN(c3ccccc3OC)CC2)ccn1
InChIInChI=1S/C22H30N4O2/c1-3-4-7-11-24-22(27)19-17-18(10-12-23-19)25-13-15-26(16-14-25)20-8-5-6-9-21(20)28-2/h5-6,8-10,12,17H,3-4,7,11,13-16H2,1-2H3,(H,24,27)
InChIKeyZNFINDASLOUTIC-UHFFFAOYSA-N
XLogP3.34
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyrazine-2-carboxamide
CID 109286431
4-(azepan-1-yl)-N-pentylpyridine-2-carboxamide
CID 109217503
4-(2-methoxyphenyl)-N-pentylpiperazine-1-carboxamide
CID 41353621
5-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184245
4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-pentylpyridine-2-carboxamide
CID 109213863
N-butyl-4-(2-methoxyphenyl)piperazine-1-carboxamide
CID 6468080
[4-(azepan-1-yl)-2-pyridinyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 109216068
4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109206099
6-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methoxypropyl)-2-methylpyrimidine-4-carboxamide
CID 109365209
N-(3-methoxypropyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204551
5-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181067
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyrimidin-4-amine
CID 112898256

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide?
The IUPAC name of 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide (CID 109216074) is 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide.
What is the SMILES notation for 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide?
The canonical SMILES for 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide is CCCCCNC(=O)c1cc(N2CCN(c3ccccc3OC)CC2)ccn1.
What is the InChIKey of 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide?
The InChIKey is ZNFINDASLOUTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O2/c1-3-4-7-11-24-22(27)19-17-18(10-12-23-19)25-13-15-26(16-14-25)20-8-5-6-9-21(20)28-2/h5-6,8-10,12,17H,3-4,7,11,13-16H2,1-2H3,(H,24,27).
What are the key properties of 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide?
4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide has a molecular weight of 382.51 g/mol, XLogP of 3.34, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-pentylpyridine-2-carboxamide is sourced from PubChem (CID 109216074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).