4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide

C14H28N2O — CID 115157434

IUPAC4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide
SMILESCC(C)(CN)CC(=O)NCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-14(2,11-15)10-13(17)16-9-8-12-6-4-3-5-7-12/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyOQBMEUIHLUHAMT-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.45
Rot. Bonds6

About 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide

4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide (PubChem CID 115157434) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide
PubChem CID115157434
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide
SMILESCC(C)(CN)CC(=O)NCCC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-14(2,11-15)10-13(17)16-9-8-12-6-4-3-5-7-12/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyOQBMEUIHLUHAMT-UHFFFAOYSA-N
XLogP2.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-3,3-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]butanamide
CID 115157360
3-amino-N-(2-cyclohexylethyl)butanamide;hydrochloride
CID 119725742
methyl 3-(2-cyclopentylethylamino)-3-oxopropanoate
CID 115174490
4-(2-cyclohexylethylamino)-4-oxobutanoic acid
CID 60919559
4-amino-N-(2-cyclobutylethyl)-3-methoxybutanamide
CID 103156672
2-amino-N-(2-cyclopentylethyl)-2-cyclopropylpropanamide
CID 60919572
2-(1-aminocyclohexyl)-N-(2-cyclohexylethyl)acetamide
CID 64683670
N-(2-cyclohexylethyl)-2-[(S)-ethylsulfinyl]acetamide
CID 97228051
2-chloro-N-(2-cyclobutylethyl)acetamide
CID 115879965
(2R)-2-amino-N-(2-cyclohexylethyl)-3-methylbutanamide
CID 79012516
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195699
(2S)-2-amino-N-(2-cyclohexylethyl)-3-hydroxypropanamide
CID 70364930

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide?
The IUPAC name of 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide (CID 115157434) is 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide.
What is the SMILES notation for 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide?
The canonical SMILES for 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide is CC(C)(CN)CC(=O)NCCC1CCCCC1.
What is the InChIKey of 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide?
The InChIKey is OQBMEUIHLUHAMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2,11-15)10-13(17)16-9-8-12-6-4-3-5-7-12/h12H,3-11,15H2,1-2H3,(H,16,17).
What are the key properties of 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide?
4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide has a molecular weight of 240.39 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-cyclohexylethyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 115157434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).