N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide

C24H32N2O — CID 100516526

IUPACN-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide
SMILESCC[C@@H]1CCCCN1CCCNC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H32N2O/c1-2-23-11-6-7-17-26(23)18-8-16-25-24(27)19-20-12-14-22(15-13-20)21-9-4-3-5-10-21/h3-5,9-10,12-15,23H,2,6-8,11,16-19H2,1H3,(H,25,27)/t23-/m1/s1
InChIKeyZGFKXMGJHQKLIZ-HSZRJFAPSA-N
MW364.53 g/mol
LogP4.67
Rot. Bonds8

About N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide

N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide (PubChem CID 100516526) has the molecular formula C24H32N2O and a molecular weight of 364.53 g/mol. Its IUPAC name is N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide
PubChem CID100516526
Molecular FormulaC24H32N2O
Molecular Weight364.53 g/mol
Exact Mass364.25
IUPAC NameN-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide
SMILESCC[C@@H]1CCCCN1CCCNC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H32N2O/c1-2-23-11-6-7-17-26(23)18-8-16-25-24(27)19-20-12-14-22(15-13-20)21-9-4-3-5-10-21/h3-5,9-10,12-15,23H,2,6-8,11,16-19H2,1H3,(H,25,27)/t23-/m1/s1
InChIKeyZGFKXMGJHQKLIZ-HSZRJFAPSA-N
XLogP4.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.53
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(4-fluorophenyl)acetamide
CID 133202306
N-[4-[2-[3-(2-ethylpiperidin-1-yl)propylamino]-2-oxoethyl]phenyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 50791553
N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]propanamide
CID 125053056
N-[3-[(2S)-2-ethylpiperidin-1-yl]propyl]-2-(4-methoxy-3-methylphenyl)acetamide
CID 100744322
3-(3,4-dichlorophenyl)-N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]propanamide
CID 100596826
2-(2-benzoylpyrrol-1-yl)-N-[3-(2-ethylpiperidin-1-yl)propyl]acetamide
CID 20889255
N-[3-[(2S)-2-ethylpiperidin-1-yl]propyl]-2-methylpropanamide
CID 99866850
N-[3-(2-ethylpiperidin-1-yl)propyl]cyclopentanecarboxamide
CID 133199610
N-[3-(2-ethylpiperidin-1-yl)propyl]-3,4-dimethylbenzamide
CID 133167577
N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]pyridine-3-carboxamide
CID 100629368
N-[3-(2-ethylpiperidin-1-yl)propyl]indolizine-2-carboxamide
CID 46388323
N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(2-fluoro-N-methylsulfonylanilino)acetamide
CID 43895820

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide (CID 100516526) is N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide is CC[C@@H]1CCCCN1CCCNC(=O)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide?
The InChIKey is ZGFKXMGJHQKLIZ-HSZRJFAPSA-N. The full InChI is InChI=1S/C24H32N2O/c1-2-23-11-6-7-17-26(23)18-8-16-25-24(27)19-20-12-14-22(15-13-20)21-9-4-3-5-10-21/h3-5,9-10,12-15,23H,2,6-8,11,16-19H2,1H3,(H,25,27)/t23-/m1/s1.
What are the key properties of N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide?
N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide has a molecular weight of 364.53 g/mol, XLogP of 4.67, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 100516526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).