N-(4-amino-3-piperidin-1-ylphenyl)acetamide

C13H19N3O — CID 69310437

IUPACN-(4-amino-3-piperidin-1-ylphenyl)acetamide
SMILESCC(=O)Nc1ccc(N)c(N2CCCCC2)c1
InChIInChI=1S/C13H19N3O/c1-10(17)15-11-5-6-12(14)13(9-11)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8,14H2,1H3,(H,15,17)
InChIKeyNUSPQCXJJXKQPO-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.22
Rot. Bonds2

About N-(4-amino-3-piperidin-1-ylphenyl)acetamide

N-(4-amino-3-piperidin-1-ylphenyl)acetamide (PubChem CID 69310437) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(4-amino-3-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-amino-3-piperidin-1-ylphenyl)acetamide
PubChem CID69310437
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(4-amino-3-piperidin-1-ylphenyl)acetamide
SMILESCC(=O)Nc1ccc(N)c(N2CCCCC2)c1
InChIInChI=1S/C13H19N3O/c1-10(17)15-11-5-6-12(14)13(9-11)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8,14H2,1H3,(H,15,17)
InChIKeyNUSPQCXJJXKQPO-UHFFFAOYSA-N
XLogP2.22
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-acetamido-2-piperidin-1-ylbenzamide
CID 69312911
N-[4-(azepan-1-yl)-3-fluorophenyl]acetamide
CID 155741497
1-(4-amino-3-pyrrolidin-1-ylphenyl)ethanone
CID 165012746
N-(3-amino-4-piperidin-1-ylphenyl)-2-methylpropanamide
CID 91676092
N-(3-amino-4-morpholin-4-ylphenyl)acetamide
CID 42560587
4-amino-3-(azocan-1-yl)-N-methylbenzamide
CID 63356679
N-(3-amino-4-pyrrolidin-1-ylphenyl)butanamide
CID 91676069
5-acetamido-N-(3-methoxypropyl)-2-piperidin-1-ylbenzamide
CID 3470167
5-acetamido-N-[3-(dimethylamino)propyl]-2-piperidin-1-ylbenzamide
CID 42757059
4-amino-3-pyrrolidin-1-ylbenzamide
CID 63355693
N-(3-amino-4-piperidin-1-ylphenyl)-3-methylbenzamide
CID 91676338
4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide
CID 53145950

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3-piperidin-1-ylphenyl)acetamide?
The IUPAC name of N-(4-amino-3-piperidin-1-ylphenyl)acetamide (CID 69310437) is N-(4-amino-3-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for N-(4-amino-3-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for N-(4-amino-3-piperidin-1-ylphenyl)acetamide is CC(=O)Nc1ccc(N)c(N2CCCCC2)c1.
What is the InChIKey of N-(4-amino-3-piperidin-1-ylphenyl)acetamide?
The InChIKey is NUSPQCXJJXKQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10(17)15-11-5-6-12(14)13(9-11)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8,14H2,1H3,(H,15,17).
What are the key properties of N-(4-amino-3-piperidin-1-ylphenyl)acetamide?
N-(4-amino-3-piperidin-1-ylphenyl)acetamide has a molecular weight of 233.31 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-3-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 69310437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).