2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide

C16H24N2O2 — CID 63825291

IUPAC2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide
SMILESCc1cccc(N)c1C(=O)NCCOC1CCCCC1
InChIInChI=1S/C16H24N2O2/c1-12-6-5-9-14(17)15(12)16(19)18-10-11-20-13-7-3-2-4-8-13/h5-6,9,13H,2-4,7-8,10-11,17H2,1H3,(H,18,19)
InChIKeyALUHDRWZUXRWGF-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.66
Rot. Bonds5

About 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide

2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide (PubChem CID 63825291) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide
PubChem CID63825291
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide
SMILESCc1cccc(N)c1C(=O)NCCOC1CCCCC1
InChIInChI=1S/C16H24N2O2/c1-12-6-5-9-14(17)15(12)16(19)18-10-11-20-13-7-3-2-4-8-13/h5-6,9,13H,2-4,7-8,10-11,17H2,1H3,(H,18,19)
InChIKeyALUHDRWZUXRWGF-UHFFFAOYSA-N
XLogP2.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-N-(2-cyclohexyloxyethyl)-3-methylbenzene-1,2-diamine
CID 115550552
3-amino-2-chloro-N-(2-cyclopentyloxyethyl)benzamide
CID 112575924
2-amino-N-(3-methoxypropyl)-6-methylbenzamide
CID 43153249
N-(3-cyclohexyloxypropyl)-2-fluoro-3-methylbenzamide
CID 80710683
2-amino-6-methyl-N-(2-prop-2-enoxyethyl)benzamide
CID 114264552
2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzenesulfonamide
CID 63825126
5-amino-N-(2-cyclohexyloxyethyl)-2-fluoro-3-methylbenzamide
CID 103296492
2-amino-6-methyl-N-(7-methyloctyl)benzamide
CID 107814563
2-amino-6-methyl-N-(4-methylpentyl)benzamide
CID 61125190
5-amino-N-(2-cyclopentyloxyethyl)-2-fluoro-3-methylbenzamide
CID 103296491
5-bromo-N-(2-cycloheptyloxyethyl)-3-methylfuran-2-carboxamide
CID 136526522
N-[2-(4-aminocyclohexyl)oxyethyl]-2-hydroxy-3-methylbenzamide
CID 63870129

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide?
The IUPAC name of 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide (CID 63825291) is 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide.
What is the SMILES notation for 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide?
The canonical SMILES for 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide is Cc1cccc(N)c1C(=O)NCCOC1CCCCC1.
What is the InChIKey of 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide?
The InChIKey is ALUHDRWZUXRWGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-6-5-9-14(17)15(12)16(19)18-10-11-20-13-7-3-2-4-8-13/h5-6,9,13H,2-4,7-8,10-11,17H2,1H3,(H,18,19).
What are the key properties of 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide?
2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide has a molecular weight of 276.38 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyclohexyloxyethyl)-6-methylbenzamide is sourced from PubChem (CID 63825291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).