2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide

C14H28N2O — CID 131855382

IUPAC2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide
SMILESCCN(CC)CC(=O)NC1[C@@H](C)CCC[C@@H]1C
InChIInChI=1S/C14H28N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h11-12,14H,5-10H2,1-4H3,(H,15,17)/t11-,12-/m0/s1
InChIKeyRECKISPZICHUQW-RYUDHWBXSA-N
MW240.39 g/mol
LogP2.27
Rot. Bonds5

About 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide

2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide (PubChem CID 131855382) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide
PubChem CID131855382
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide
SMILESCCN(CC)CC(=O)NC1[C@@H](C)CCC[C@@H]1C
InChIInChI=1S/C14H28N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h11-12,14H,5-10H2,1-4H3,(H,15,17)/t11-,12-/m0/s1
InChIKeyRECKISPZICHUQW-RYUDHWBXSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dimethylcyclohexyl)-2-(methylamino)acetamide
CID 130677976
N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide
CID 24832141
2-(diethylamino)-N-(3-methylpiperidin-4-yl)acetamide;dihydrochloride
CID 120553416
methyl 3-[ethyl-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]amino]propanoate
CID 62026217
N-(6-bicyclo[3.1.0]hexanyl)-2-(dimethylamino)acetamide
CID 130670911
N-cycloheptyl-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 60685926
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethylamino]-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]acetamide
CID 11933395
2-[(2,6-dimethylcyclohexyl)amino]-N,N-diethylpropanamide
CID 43739395
2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide
CID 129419826
3-[(2,6-dimethylcyclohexyl)carbamoyl-methylamino]propanoic acid
CID 122004955
2-[2-aminoethyl(ethyl)amino]-N-cyclopropylacetamide
CID 61349324
3-[(2R,6S)-2,6-dimethylcyclohexyl]-1-ethyl-1-[[(2R)-oxolan-2-yl]methyl]urea
CID 95972940

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide?
The IUPAC name of 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide (CID 131855382) is 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide.
What is the SMILES notation for 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide?
The canonical SMILES for 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide is CCN(CC)CC(=O)NC1[C@@H](C)CCC[C@@H]1C.
What is the InChIKey of 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide?
The InChIKey is RECKISPZICHUQW-RYUDHWBXSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h11-12,14H,5-10H2,1-4H3,(H,15,17)/t11-,12-/m0/s1.
What are the key properties of 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide?
2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[(2S,6S)-2,6-dimethylcyclohexyl]acetamide is sourced from PubChem (CID 131855382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).