N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide

C14H21N3O2 — CID 16786515

IUPACN-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide
SMILESNCc1cccc(NC(=O)CN2CCC(O)CC2)c1
InChIInChI=1S/C14H21N3O2/c15-9-11-2-1-3-12(8-11)16-14(19)10-17-6-4-13(18)5-7-17/h1-3,8,13,18H,4-7,9-10,15H2,(H,16,19)
InChIKeyABTGQGFDUXOYME-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.54
Rot. Bonds4

About N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide

N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide (PubChem CID 16786515) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide
PubChem CID16786515
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide
SMILESNCc1cccc(NC(=O)CN2CCC(O)CC2)c1
InChIInChI=1S/C14H21N3O2/c15-9-11-2-1-3-12(8-11)16-14(19)10-17-6-4-13(18)5-7-17/h1-3,8,13,18H,4-7,9-10,15H2,(H,16,19)
InChIKeyABTGQGFDUXOYME-UHFFFAOYSA-N
XLogP0.54
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide 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

N-[3-(aminomethyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 16779298
N-[3-(aminomethyl)phenyl]-2-(4-cyclopropylpiperazin-1-yl)acetamide
CID 61440797
N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide
CID 16779234
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
2-(4-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 31480654
N-[3-(aminomethyl)phenyl]-2-(3,4-dimethoxypyrrolidin-1-yl)acetamide
CID 103531213
N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)propanamide
CID 16782680
N-(3-ethylphenyl)-2-[4-(methylamino)piperidin-1-yl]acetamide
CID 119923733
N-[3-(aminomethyl)phenyl]-2-(2-methylpiperidin-1-yl)acetamide
CID 16779184
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-(3-iodophenyl)acetamide
CID 78962531
2-(3-aminopyrrolidin-1-yl)-N-(3-ethylphenyl)acetamide
CID 62067698
N-[4-(aminomethyl)phenyl]-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246107

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide?
The IUPAC name of N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide (CID 16786515) is N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide is NCc1cccc(NC(=O)CN2CCC(O)CC2)c1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide?
The InChIKey is ABTGQGFDUXOYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c15-9-11-2-1-3-12(8-11)16-14(19)10-17-6-4-13(18)5-7-17/h1-3,8,13,18H,4-7,9-10,15H2,(H,16,19).
What are the key properties of N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide?
N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide has a molecular weight of 263.34 g/mol, XLogP of 0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide is sourced from PubChem (CID 16786515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).