4-amino-N-cyclohexyl-3-methylbenzamide

C14H20N2O — CID 16773559

IUPAC4-amino-N-cyclohexyl-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CCCCC2)ccc1N
InChIInChI=1S/C14H20N2O/c1-10-9-11(7-8-13(10)15)14(17)16-12-5-3-2-4-6-12/h7-9,12H,2-6,15H2,1H3,(H,16,17)
InChIKeySBGJPNBLQXCNHV-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.64
Rot. Bonds2

About 4-amino-N-cyclohexyl-3-methylbenzamide

4-amino-N-cyclohexyl-3-methylbenzamide (PubChem CID 16773559) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-amino-N-cyclohexyl-3-methylbenzamide.

Molecular Properties

Compound Name4-amino-N-cyclohexyl-3-methylbenzamide
PubChem CID16773559
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-amino-N-cyclohexyl-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CCCCC2)ccc1N
InChIInChI=1S/C14H20N2O/c1-10-9-11(7-8-13(10)15)14(17)16-12-5-3-2-4-6-12/h7-9,12H,2-6,15H2,1H3,(H,16,17)
InChIKeySBGJPNBLQXCNHV-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-4-hydroxy-3-methylbenzamide
CID 113355938
4-bromo-N-cyclopentyl-3-methylbenzamide
CID 46738751
4-amino-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373277
4-amino-N-cyclooctyl-3-fluorobenzamide
CID 62679448
N-cyclobutyl-3,4-dimethylbenzamide;ethane
CID 142916267
4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761
4-amino-3-methyl-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 30117194
4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide
CID 54915908
4-amino-N-(1-tert-butylpiperidin-4-yl)-3-methylbenzamide
CID 60945933
4-amino-N-(2-tert-butylcyclohexyl)-3-methylbenzamide
CID 43699383
N-cycloheptyl-4-(ethylamino)-3-methylbenzamide
CID 63210563
N-cyclooctyl-4-methylbenzamide
CID 3995245

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclohexyl-3-methylbenzamide?
The IUPAC name of 4-amino-N-cyclohexyl-3-methylbenzamide (CID 16773559) is 4-amino-N-cyclohexyl-3-methylbenzamide.
What is the SMILES notation for 4-amino-N-cyclohexyl-3-methylbenzamide?
The canonical SMILES for 4-amino-N-cyclohexyl-3-methylbenzamide is Cc1cc(C(=O)NC2CCCCC2)ccc1N.
What is the InChIKey of 4-amino-N-cyclohexyl-3-methylbenzamide?
The InChIKey is SBGJPNBLQXCNHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-9-11(7-8-13(10)15)14(17)16-12-5-3-2-4-6-12/h7-9,12H,2-6,15H2,1H3,(H,16,17).
What are the key properties of 4-amino-N-cyclohexyl-3-methylbenzamide?
4-amino-N-cyclohexyl-3-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclohexyl-3-methylbenzamide is sourced from PubChem (CID 16773559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).