N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide

C12H23NO3 — CID 106123782

IUPACN-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)NCC1CCC(O)CC1
InChIInChI=1S/C12H23NO3/c1-12(2,16-3)11(15)13-8-9-4-6-10(14)7-5-9/h9-10,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyADBRIKMMDIUISA-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.08
Rot. Bonds4

About N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide

N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide (PubChem CID 106123782) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide
PubChem CID106123782
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC NameN-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)NCC1CCC(O)CC1
InChIInChI=1S/C12H23NO3/c1-12(2,16-3)11(15)13-8-9-4-6-10(14)7-5-9/h9-10,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyADBRIKMMDIUISA-UHFFFAOYSA-N
XLogP1.08
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[(2-methoxy-2-methylpropanoyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 103018968
2-amino-N-[(4-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 106135736
3-amino-N-[(4-hydroxycyclohexyl)methyl]-2,2,3-trimethylbutanamide
CID 114148256
2-amino-N-[(4-hydroxycyclohexyl)methyl]-2-methylbutanamide
CID 106135461
N-[(4-hydroxycyclohexyl)methyl]-2-methyl-2-methylsulfonylpropanamide
CID 114146309
2-amino-3,3,3-trifluoro-N-[(4-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 106135692
N-[(3-aminocyclohexyl)methyl]-2-methoxy-2-methylpropanamide
CID 106123178
N-(2-cyclobutylethyl)-2-methoxy-2-methylpropanamide
CID 103747323
2-methoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107420812
N-[(2-hydroxycyclopentyl)methyl]-2-methoxy-2-methylpropanamide
CID 103708572
N-[(2-aminocyclopentyl)methyl]-2-methoxy-2-methylpropanamide
CID 103022530
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-methoxy-2-methylpropanamide
CID 103021126

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide?
The IUPAC name of N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide (CID 106123782) is N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide is COC(C)(C)C(=O)NCC1CCC(O)CC1.
What is the InChIKey of N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide?
The InChIKey is ADBRIKMMDIUISA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-12(2,16-3)11(15)13-8-9-4-6-10(14)7-5-9/h9-10,14H,4-8H2,1-3H3,(H,13,15).
What are the key properties of N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide?
N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide has a molecular weight of 229.32 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide is sourced from PubChem (CID 106123782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).