N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide

C13H18N2O — CID 103164982

IUPACN-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide
SMILESNCc1ccccc1NC(=O)CC1CCC1
InChIInChI=1S/C13H18N2O/c14-9-11-6-1-2-7-12(11)15-13(16)8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,14H2,(H,15,16)
InChIKeyJGUSRBNQBXLDIR-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.27
Rot. Bonds4

About N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide

N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide (PubChem CID 103164982) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide
PubChem CID103164982
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide
SMILESNCc1ccccc1NC(=O)CC1CCC1
InChIInChI=1S/C13H18N2O/c14-9-11-6-1-2-7-12(11)15-13(16)8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,14H2,(H,15,16)
InChIKeyJGUSRBNQBXLDIR-UHFFFAOYSA-N
XLogP2.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide 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

2-cyclopentyl-N-[2-(ethylaminomethyl)phenyl]acetamide
CID 60776430
2-cyclobutyl-N-(2-iodophenyl)acetamide
CID 103706273
N-[2-(chloromethyl)phenyl]-2-cyclopropylacetamide
CID 114298279
2-cyclopentyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 71896430
N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
CID 119259903
2-cyclobutyl-N-(2-sulfamoylphenyl)acetamide
CID 103166193
N-[2-(aminomethyl)phenyl]-2-cyclohexylsulfonylacetamide
CID 64696815
N-[2-(aminomethyl)phenyl]-3-(cyclopentylmethylsulfinyl)propanamide
CID 81334230
N-[2-(aminomethyl)phenyl]-2-cyclopentyloxyacetamide
CID 16795947
2-[2-[[2-(3-methylcyclohexyl)acetyl]amino]phenyl]acetic acid
CID 119218559
N-(2-bromophenyl)-2-cyclopentylacetamide
CID 24707693
2-cyclohexyl-N-(2-methoxyphenyl)acetamide
CID 880879

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide (CID 103164982) is N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide is NCc1ccccc1NC(=O)CC1CCC1.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide?
The InChIKey is JGUSRBNQBXLDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c14-9-11-6-1-2-7-12(11)15-13(16)8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,14H2,(H,15,16).
What are the key properties of N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide?
N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide has a molecular weight of 218.30 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide is sourced from PubChem (CID 103164982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).