N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide

C12H22N2O2 — CID 23292846

IUPACN-(5-acetamido-3,3-dimethylcyclohexyl)acetamide
SMILESCC(=O)NC1CC(NC(C)=O)CC(C)(C)C1
InChIInChI=1S/C12H22N2O2/c1-8(15)13-10-5-11(14-9(2)16)7-12(3,4)6-10/h10-11H,5-7H2,1-4H3,(H,13,15)(H,14,16)
InChIKeyYJYPJHPEEKTQLF-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.21
Rot. Bonds2

About N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide

N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide (PubChem CID 23292846) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-3,3-dimethylcyclohexyl)acetamide
PubChem CID23292846
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(5-acetamido-3,3-dimethylcyclohexyl)acetamide
SMILESCC(=O)NC1CC(NC(C)=O)CC(C)(C)C1
InChIInChI=1S/C12H22N2O2/c1-8(15)13-10-5-11(14-9(2)16)7-12(3,4)6-10/h10-11H,5-7H2,1-4H3,(H,13,15)(H,14,16)
InChIKeyYJYPJHPEEKTQLF-UHFFFAOYSA-N
XLogP1.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,5S)-3,3,5-trimethylcyclohexyl]acetamide
CID 67074228
N-(3,3,6,6-tetramethylcycloheptyl)acetamide
CID 142825671
N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 156735738
N-(3-acetamido-3,5,5-trimethylcyclohexyl)acetamide
CID 20647612
N-[(1R,3S)-3-(methylamino)cyclopentyl]acetamide
CID 139574017
ethane;N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 178170769
N-(3-iodocyclobutyl)acetamide
CID 145126673
N-(3,6-dimethylcycloheptyl)acetamide
CID 89468976
N-(3,3-dimethylcyclobutyl)-2,2-dimethylpropanamide
CID 130996425
N-(3-hydroxy-3-methylcyclohexyl)acetamide
CID 139373491
N-[(1R,3R)-3-hydroxy-3-methylcyclohexyl]acetamide
CID 162469361
N-[3-(buta-1,3-dien-2-ylamino)cyclobutyl]acetamide
CID 157408507

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide?
The IUPAC name of N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide (CID 23292846) is N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide.
What is the SMILES notation for N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide?
The canonical SMILES for N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide is CC(=O)NC1CC(NC(C)=O)CC(C)(C)C1.
What is the InChIKey of N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide?
The InChIKey is YJYPJHPEEKTQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-8(15)13-10-5-11(14-9(2)16)7-12(3,4)6-10/h10-11H,5-7H2,1-4H3,(H,13,15)(H,14,16).
What are the key properties of N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide?
N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide has a molecular weight of 226.32 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide is sourced from PubChem (CID 23292846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).