N-butyl-2-(2-cyclohexylethylamino)acetamide

C14H28N2O — CID 60976119

IUPACN-butyl-2-(2-cyclohexylethylamino)acetamide
SMILESCCCCNC(=O)CNCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-2-3-10-16-14(17)12-15-11-9-13-7-5-4-6-8-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyXGHYKSQKUMKMHM-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.46
Rot. Bonds8

About N-butyl-2-(2-cyclohexylethylamino)acetamide

N-butyl-2-(2-cyclohexylethylamino)acetamide (PubChem CID 60976119) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-butyl-2-(2-cyclohexylethylamino)acetamide.

Molecular Properties

Compound NameN-butyl-2-(2-cyclohexylethylamino)acetamide
PubChem CID60976119
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-butyl-2-(2-cyclohexylethylamino)acetamide
SMILESCCCCNC(=O)CNCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-2-3-10-16-14(17)12-15-11-9-13-7-5-4-6-8-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyXGHYKSQKUMKMHM-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyclohexylethylamino)-N-(3-methoxypropyl)acetamide
CID 54957148
2-(2-cyclopentylethylamino)-N-methylacetamide
CID 60919375
3-cyclohexyl-N-undecylpropanamide
CID 5146202
N-(2-cyclohexylethyl)butan-1-amine;hydrochloride
CID 57440786
butyl 2-(2-cyclohexylethylamino)acetate
CID 54932803
2-cyclohexyl-N-octylacetamide
CID 3547359
N-butyl-2-(2-cyclopropylpropan-2-ylamino)acetamide
CID 103950002
N-carbamoyl-2-(2-cyclohexylethylamino)acetamide
CID 60920757
3-(2-cyclohexylethylamino)-N-ethylpropanamide
CID 62324401
N-butyl-2-[(3-methylcyclopentyl)methylamino]acetamide
CID 107412540
N-pentyl-2-(pentylamino)acetamide
CID 109005932
N-(2-cyclobutylethyl)-2-(cyclopropylmethylamino)acetamide
CID 115739981

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(2-cyclohexylethylamino)acetamide?
The IUPAC name of N-butyl-2-(2-cyclohexylethylamino)acetamide (CID 60976119) is N-butyl-2-(2-cyclohexylethylamino)acetamide.
What is the SMILES notation for N-butyl-2-(2-cyclohexylethylamino)acetamide?
The canonical SMILES for N-butyl-2-(2-cyclohexylethylamino)acetamide is CCCCNC(=O)CNCCC1CCCCC1.
What is the InChIKey of N-butyl-2-(2-cyclohexylethylamino)acetamide?
The InChIKey is XGHYKSQKUMKMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-3-10-16-14(17)12-15-11-9-13-7-5-4-6-8-13/h13,15H,2-12H2,1H3,(H,16,17).
What are the key properties of N-butyl-2-(2-cyclohexylethylamino)acetamide?
N-butyl-2-(2-cyclohexylethylamino)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(2-cyclohexylethylamino)acetamide is sourced from PubChem (CID 60976119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).