3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide

C13H24N2O3 — CID 111331912

IUPAC3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC(=O)CC1(O)CCCCC1)C(N)=O
InChIInChI=1S/C13H24N2O3/c1-12(2,11(14)17)9-15-10(16)8-13(18)6-4-3-5-7-13/h18H,3-9H2,1-2H3,(H2,14,17)(H,15,16)
InChIKeyFEJOCAYEZJWARN-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.70
Rot. Bonds5

About 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide

3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide (PubChem CID 111331912) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide
PubChem CID111331912
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC(=O)CC1(O)CCCCC1)C(N)=O
InChIInChI=1S/C13H24N2O3/c1-12(2,11(14)17)9-15-10(16)8-13(18)6-4-3-5-7-13/h18H,3-9H2,1-2H3,(H2,14,17)(H,15,16)
InChIKeyFEJOCAYEZJWARN-UHFFFAOYSA-N
XLogP0.70
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide 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

N-[2-[[2-(1-hydroxycyclohexyl)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 71984658
N-(3-fluoropropyl)-2-(1-hydroxycyclohexyl)acetamide
CID 112349435
2-(1-hydroxycyclohexyl)-N-(5,5,5-trifluoropentyl)acetamide
CID 112419208
n,n-Diethyl-2-(1-hydroxycyclohexyl)acetamide
CID 222426
2-(1-hydroxycyclohexyl)-N-methylhexanamide
CID 53814015
N-hexyl-2-(1-hydroxycyclohexyl)acetamide
CID 111331734
2-(1-hydroxycyclohexyl)-N-methylacetamide
CID 126996870
N-cyclohexyl-2-(1-hydroxycyclohexyl)acetamide
CID 141116363
2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide
CID 141152203
N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide
CID 175786245
N-[3-[(1-hydroxycyclohexyl)methylamino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 64865915
N-[(1-hydroxycyclohexyl)methyl]octanamide
CID 64866136

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide (CID 111331912) is 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide is CC(C)(CNC(=O)CC1(O)CCCCC1)C(N)=O.
What is the InChIKey of 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide?
The InChIKey is FEJOCAYEZJWARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-12(2,11(14)17)9-15-10(16)8-13(18)6-4-3-5-7-13/h18H,3-9H2,1-2H3,(H2,14,17)(H,15,16).
What are the key properties of 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide?
3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide has a molecular weight of 256.35 g/mol, XLogP of 0.70, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(1-hydroxycyclohexyl)acetyl]amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 111331912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).