N-(2-aminocyclohexyl)-4-methylbenzamide

C14H20N2O — CID 61037352

IUPACN-(2-aminocyclohexyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCCCC2N)cc1
InChIInChI=1S/C14H20N2O/c1-10-6-8-11(9-7-10)14(17)16-13-5-3-2-4-12(13)15/h6-9,12-13H,2-5,15H2,1H3,(H,16,17)
InChIKeyXONCOGUYTUKBTI-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.99
Rot. Bonds2

About N-(2-aminocyclohexyl)-4-methylbenzamide

N-(2-aminocyclohexyl)-4-methylbenzamide (PubChem CID 61037352) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-4-methylbenzamide
PubChem CID61037352
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(2-aminocyclohexyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCCCC2N)cc1
InChIInChI=1S/C14H20N2O/c1-10-6-8-11(9-7-10)14(17)16-13-5-3-2-4-12(13)15/h6-9,12-13H,2-5,15H2,1H3,(H,16,17)
InChIKeyXONCOGUYTUKBTI-UHFFFAOYSA-N
XLogP1.99
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
N-(2-aminocyclohexyl)-4-(dimethylamino)benzamide
CID 61037234
N-(2-aminocycloheptyl)-4-chlorobenzamide
CID 63258248
N-(2-aminocycloheptyl)-4-methylsulfonylbenzamide
CID 63258076
N-[2-(bromomethyl)cyclohexyl]-4-methylbenzamide
CID 114179665
N-(2-aminocyclohexyl)-3-fluoro-4-methylbenzamide
CID 61038354
N-(2-aminocycloheptyl)-4-hydroxy-3-methylbenzamide
CID 107672030
N-[(1R,2R)-2-aminocyclohexyl]-2-(4-methylphenyl)acetamide
CID 93451691
1-(2-aminocyclohexyl)-3-(4-methylphenyl)urea
CID 55150019
N-(2-aminocyclohexyl)-5-methylfuran-3-carboxamide
CID 114821924
N-(2-aminocyclohexyl)-3-chloro-5-methylbenzamide
CID 81323198

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-4-methylbenzamide?
The IUPAC name of N-(2-aminocyclohexyl)-4-methylbenzamide (CID 61037352) is N-(2-aminocyclohexyl)-4-methylbenzamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-4-methylbenzamide?
The canonical SMILES for N-(2-aminocyclohexyl)-4-methylbenzamide is Cc1ccc(C(=O)NC2CCCCC2N)cc1.
What is the InChIKey of N-(2-aminocyclohexyl)-4-methylbenzamide?
The InChIKey is XONCOGUYTUKBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-6-8-11(9-7-10)14(17)16-13-5-3-2-4-12(13)15/h6-9,12-13H,2-5,15H2,1H3,(H,16,17).
What are the key properties of N-(2-aminocyclohexyl)-4-methylbenzamide?
N-(2-aminocyclohexyl)-4-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-4-methylbenzamide is sourced from PubChem (CID 61037352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).