N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide

C13H25NO2 — CID 56764278

IUPACN-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCC(O)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)
InChIKeyMEMFNBRMCHBAMW-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.09
Rot. Bonds3

About N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide

N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide (PubChem CID 56764278) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide
PubChem CID56764278
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCC(O)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)
InChIKeyMEMFNBRMCHBAMW-UHFFFAOYSA-N
XLogP2.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide (CID 56764278) is N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)NCC(O)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide?
The InChIKey is MEMFNBRMCHBAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16).
What are the key properties of N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide?
N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide has a molecular weight of 227.35 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-2-hydroxyethyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 56764278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).