N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide

C11H21NO2 — CID 137457356

IUPACN-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide
SMILESCC(C)C(=O)NC1CCCCC1(C)O
InChIInChI=1S/C11H21NO2/c1-8(2)10(13)12-9-6-4-5-7-11(9,3)14/h8-9,14H,4-7H2,1-3H3,(H,12,13)
InChIKeyOSHUNGBWHRQDJX-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.45
Rot. Bonds2

About N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide

N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide (PubChem CID 137457356) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide
PubChem CID137457356
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide
SMILESCC(C)C(=O)NC1CCCCC1(C)O
InChIInChI=1S/C11H21NO2/c1-8(2)10(13)12-9-6-4-5-7-11(9,3)14/h8-9,14H,4-7H2,1-3H3,(H,12,13)
InChIKeyOSHUNGBWHRQDJX-UHFFFAOYSA-N
XLogP1.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide?
The IUPAC name of N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide (CID 137457356) is N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide.
What is the SMILES notation for N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide?
The canonical SMILES for N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide is CC(C)C(=O)NC1CCCCC1(C)O.
What is the InChIKey of N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide?
The InChIKey is OSHUNGBWHRQDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(2)10(13)12-9-6-4-5-7-11(9,3)14/h8-9,14H,4-7H2,1-3H3,(H,12,13).
What are the key properties of N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide?
N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide has a molecular weight of 199.29 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylcyclohexyl)-2-methylpropanamide is sourced from PubChem (CID 137457356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).