N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide

C14H20N2O — CID 115267586

IUPACN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide
SMILESCN(CC1(CN)CCC1)C(=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-16(11-14(10-15)8-5-9-14)13(17)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11,15H2,1H3
InChIKeyMCACWVFWESQWPC-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.89
Rot. Bonds4

About N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide

N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide (PubChem CID 115267586) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide
PubChem CID115267586
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide
SMILESCN(CC1(CN)CCC1)C(=O)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-16(11-14(10-15)8-5-9-14)13(17)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11,15H2,1H3
InChIKeyMCACWVFWESQWPC-UHFFFAOYSA-N
XLogP1.89
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylpyridine-4-carboxamide
CID 115272186
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-4-propan-2-ylbenzamide
CID 115272619
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-chloro-N-methylbenzamide
CID 115267700
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,5-dimethylfuran-2-carboxamide
CID 115272187
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
CID 115272627
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylaniline
CID 115448798
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-1-phenylmethanamine
CID 82171579
N-(2-aminoethyl)-N-methylbenzamide
CID 28707416
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-2-pyridin-4-ylacetamide
CID 115272202
N-[[1-(aminomethyl)cyclopropyl]methyl]-3-bromo-4-methoxy-N-methylbenzamide
CID 115272631
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,3-dimethylbutanamide
CID 115267579
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-ethyl-N-methylbutanamide
CID 115267583

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide?
The IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide (CID 115267586) is N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide is CN(CC1(CN)CCC1)C(=O)c1ccccc1.
What is the InChIKey of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide?
The InChIKey is MCACWVFWESQWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-16(11-14(10-15)8-5-9-14)13(17)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11,15H2,1H3.
What are the key properties of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide?
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylbenzamide is sourced from PubChem (CID 115267586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).