N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide

C15H22N2O2 — CID 50973902

IUPACN-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide
SMILESCOCC1(C(=O)NCc2ccc(CN)cc2)CCC1
InChIInChI=1S/C15H22N2O2/c1-19-11-15(7-2-8-15)14(18)17-10-13-5-3-12(9-16)4-6-13/h3-6H,2,7-11,16H2,1H3,(H,17,18)
InChIKeyZUYPXKOKDBBZKF-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.58
Rot. Bonds6

About N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide

N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide (PubChem CID 50973902) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide
PubChem CID50973902
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide
SMILESCOCC1(C(=O)NCc2ccc(CN)cc2)CCC1
InChIInChI=1S/C15H22N2O2/c1-19-11-15(7-2-8-15)14(18)17-10-13-5-3-12(9-16)4-6-13/h3-6H,2,7-11,16H2,1H3,(H,17,18)
InChIKeyZUYPXKOKDBBZKF-UHFFFAOYSA-N
XLogP1.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide 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-benzyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616012
4-(methoxymethyl)-N-[[4-(methoxymethyl)phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120621722
1-(methoxymethyl)-N-(1H-pyrazol-5-ylmethyl)cyclobutane-1-carboxamide
CID 122564924
N-[(2-chloro-6-fluorophenyl)methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide
CID 74234343
1-(aminomethyl)-N-[(4-chlorophenyl)methyl]cyclobutane-1-carboxamide
CID 113311558
1-(aminomethyl)-N-[[3-(methoxymethyl)phenyl]methyl]cyclohexane-1-carboxamide
CID 115437615
1-(methoxymethyl)cyclobutane-1-carbohydrazide
CID 120999878
1-(aminomethyl)-N-[(4-methoxyphenyl)methyl]cyclopropane-1-carboxamide
CID 80588402
N-[[4-(ethylcarbamoyl)phenyl]methyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120621041
4-(methoxymethyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 120623903
N-[[3-[(dimethylamino)methyl]phenyl]methyl]-4-(methoxymethyl)piperidine-4-carboxamide;dihydrochloride
CID 120641219
1-(aminomethyl)-N-[(3,4-dimethylphenyl)methyl]cyclobutane-1-carboxamide
CID 115183513

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide?
The IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide (CID 50973902) is N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide.
What is the SMILES notation for N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide?
The canonical SMILES for N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide is COCC1(C(=O)NCc2ccc(CN)cc2)CCC1.
What is the InChIKey of N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide?
The InChIKey is ZUYPXKOKDBBZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-11-15(7-2-8-15)14(18)17-10-13-5-3-12(9-16)4-6-13/h3-6H,2,7-11,16H2,1H3,(H,17,18).
What are the key properties of N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide?
N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)phenyl]methyl]-1-(methoxymethyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 50973902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).