2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide

C20H32N4O — CID 43816687

IUPAC2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide
SMILESO=C(CNCCN1CCCCC1)Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C20H32N4O/c25-20(17-21-11-16-23-12-3-1-4-13-23)22-18-7-9-19(10-8-18)24-14-5-2-6-15-24/h7-10,21H,1-6,11-17H2,(H,22,25)
InChIKeyIFTXUUGZRPJJRD-UHFFFAOYSA-N
MW344.50 g/mol
LogP2.69
Rot. Bonds7

About 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide

2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide (PubChem CID 43816687) has the molecular formula C20H32N4O and a molecular weight of 344.50 g/mol. Its IUPAC name is 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide
PubChem CID43816687
Molecular FormulaC20H32N4O
Molecular Weight344.50 g/mol
Exact Mass344.26
IUPAC Name2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide
SMILESO=C(CNCCN1CCCCC1)Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C20H32N4O/c25-20(17-21-11-16-23-12-3-1-4-13-23)22-18-7-9-19(10-8-18)24-14-5-2-6-15-24/h7-10,21H,1-6,11-17H2,(H,22,25)
InChIKeyIFTXUUGZRPJJRD-UHFFFAOYSA-N
XLogP2.69
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-morpholin-4-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide
CID 43816686
N-(4-bromophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 60660272
N-(4-cyclohexylphenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 22448118
N-(4-piperidin-1-ylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78908637
3-(4-ethylpiperazin-1-yl)-N-(4-piperidin-1-ylphenyl)propanamide
CID 109017734
N-(4-piperidin-1-ylphenyl)-3-(4-pyrrolidin-1-ylanilino)propanamide
CID 109041781
2-isocyano-N-(4-piperidin-1-ylphenyl)acetamide
CID 108814796
N-(4-chlorophenyl)-2-(3-pyrrolidin-1-ylpropylamino)acetamide
CID 60673794
2-bromo-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 63680073
N-(4-piperidin-1-ylphenyl)-2-(propan-2-ylsulfamoylamino)acetamide
CID 110606260
3-(4-pyrrolidin-1-ylanilino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109041751
N-[4-(azepan-1-yl)phenyl]butanamide
CID 60593025

Frequently Asked Questions

What is the IUPAC name of 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide (CID 43816687) is 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide is O=C(CNCCN1CCCCC1)Nc1ccc(N2CCCCC2)cc1.
What is the InChIKey of 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide?
The InChIKey is IFTXUUGZRPJJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O/c25-20(17-21-11-16-23-12-3-1-4-13-23)22-18-7-9-19(10-8-18)24-14-5-2-6-15-24/h7-10,21H,1-6,11-17H2,(H,22,25).
What are the key properties of 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide?
2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide has a molecular weight of 344.50 g/mol, XLogP of 2.69, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperidin-1-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 43816687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).