4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide

C14H20N2O — CID 115161061

IUPAC4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide
SMILESCN(CCC1CCC1)C(=O)c1ccc(N)cc1
InChIInChI=1S/C14H20N2O/c1-16(10-9-11-3-2-4-11)14(17)12-5-7-13(15)8-6-12/h5-8,11H,2-4,9-10,15H2,1H3
InChIKeyIAUSQGMOXOQLGC-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.53
Rot. Bonds4

About 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide

4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide (PubChem CID 115161061) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide.

Molecular Properties

Compound Name4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide
PubChem CID115161061
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide
SMILESCN(CCC1CCC1)C(=O)c1ccc(N)cc1
InChIInChI=1S/C14H20N2O/c1-16(10-9-11-3-2-4-11)14(17)12-5-7-13(15)8-6-12/h5-8,11H,2-4,9-10,15H2,1H3
InChIKeyIAUSQGMOXOQLGC-UHFFFAOYSA-N
XLogP2.53
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 ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(2-cyclohexylethyl)-N-methylbenzamide
CID 115160809
5-amino-N-(2-cyclohexylethyl)-N,2-dimethylbenzamide
CID 120629879
2-(2-aminoethyl)-N-(2-cyclobutylethyl)-N-methylpyridine-4-carboxamide
CID 115116324
4-amino-N-(2-dimethylarsanylethyl)-N-methylbenzamide
CID 175266582
4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
CID 54945330
2-amino-N-(2-cyclohexylethyl)-N-methylbenzamide
CID 119945212
4-amino-N-[3-(dimethylamino)propyl]-N-methylbenzamide
CID 22567507
4-amino-N-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63725878
4-ethyl-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
CID 60915091
1-(2-cyclobutylethyl)-1-methylurea
CID 115168733
4-amino-N-methyl-N-(2-methylsulfanylethyl)benzamide
CID 112656326
2-amino-1-N,3-N-bis(2-cyclopropylethyl)-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 122153503

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide?
The IUPAC name of 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide (CID 115161061) is 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide.
What is the SMILES notation for 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide?
The canonical SMILES for 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide is CN(CCC1CCC1)C(=O)c1ccc(N)cc1.
What is the InChIKey of 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide?
The InChIKey is IAUSQGMOXOQLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-16(10-9-11-3-2-4-11)14(17)12-5-7-13(15)8-6-12/h5-8,11H,2-4,9-10,15H2,1H3.
What are the key properties of 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide?
4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide is sourced from PubChem (CID 115161061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).