N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide

C15H23N3O — CID 43584126

IUPACN-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCN(CC(=O)Nc2ccc(N)cc2)C1
InChIInChI=1S/C15H23N3O/c1-2-12-4-3-9-18(10-12)11-15(19)17-14-7-5-13(16)6-8-14/h5-8,12H,2-4,9-11,16H2,1H3,(H,17,19)
InChIKeyOUPAMWFFCGEPLP-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.33
Rot. Bonds4

About N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide

N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide (PubChem CID 43584126) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
PubChem CID43584126
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCN(CC(=O)Nc2ccc(N)cc2)C1
InChIInChI=1S/C15H23N3O/c1-2-12-4-3-9-18(10-12)11-15(19)17-14-7-5-13(16)6-8-14/h5-8,12H,2-4,9-11,16H2,1H3,(H,17,19)
InChIKeyOUPAMWFFCGEPLP-UHFFFAOYSA-N
XLogP2.33
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43584123
N-(4-carbamothioylphenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43584521
N-(4-aminophenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16779145
N-(4-cyanophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43430359
N-(5-amino-2-chlorophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43584042
2-(3-aminopiperidin-1-yl)-N-(4-methylphenyl)acetamide
CID 61297774
N-(4-cyanophenyl)-2-(3-ethylpyrrolidin-1-yl)acetamide
CID 112698282
N-(4-ethoxyphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60642593
N-(3-aminophenyl)-4-(3-ethylpiperidin-1-yl)butanamide
CID 43584150
2-(3-aminopiperidin-1-yl)-N-(3,4-dimethylphenyl)acetamide
CID 61298131
2-[3-(fluoromethyl)piperidin-1-yl]-N-phenylacetamide
CID 171690935
2-[(3R)-3-aminopiperidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 102977214

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide?
The IUPAC name of N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide (CID 43584126) is N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide is CCC1CCCN(CC(=O)Nc2ccc(N)cc2)C1.
What is the InChIKey of N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide?
The InChIKey is OUPAMWFFCGEPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-12-4-3-9-18(10-12)11-15(19)17-14-7-5-13(16)6-8-14/h5-8,12H,2-4,9-11,16H2,1H3,(H,17,19).
What are the key properties of N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide?
N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide has a molecular weight of 261.37 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-(3-ethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 43584126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).