N-(2-acetamido-4-methylidenecyclohexyl)acetamide

C11H18N2O2 — CID 91260534

IUPACN-(2-acetamido-4-methylidenecyclohexyl)acetamide
SMILESC=C1CCC(NC(C)=O)C(NC(C)=O)C1
InChIInChI=1S/C11H18N2O2/c1-7-4-5-10(12-8(2)14)11(6-7)13-9(3)15/h10-11H,1,4-6H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyOKZHTMJOYQYWGE-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.74
Rot. Bonds2

About N-(2-acetamido-4-methylidenecyclohexyl)acetamide

N-(2-acetamido-4-methylidenecyclohexyl)acetamide (PubChem CID 91260534) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(2-acetamido-4-methylidenecyclohexyl)acetamide.

Molecular Properties

Compound NameN-(2-acetamido-4-methylidenecyclohexyl)acetamide
PubChem CID91260534
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(2-acetamido-4-methylidenecyclohexyl)acetamide
SMILESC=C1CCC(NC(C)=O)C(NC(C)=O)C1
InChIInChI=1S/C11H18N2O2/c1-7-4-5-10(12-8(2)14)11(6-7)13-9(3)15/h10-11H,1,4-6H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyOKZHTMJOYQYWGE-UHFFFAOYSA-N
XLogP0.74
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(3-fluoro-5-methylidenecyclohexyl)acetamide
CID 90885330
N-(6-methylhept-6-en-2-yl)acetamide
CID 19865089
4-(4-Methylidenecyclohexyl)piperazin-2-one
CID 58902675
N,N-dimethyl-2-[(4-methylidenecyclohexyl)amino]acetamide
CID 58902682
N-(4-methylidenecyclohexyl)acetamide
CID 58902716
N-(4-methylidenecyclohexyl)propanamide
CID 58902762
2-[(4-Methylidenecyclohexyl)amino]acetamide
CID 58902781
N-[(3S)-6-amino-2-methylhex-1-en-3-yl]acetamide
CID 89028667
N-[(1S)-2-ethenylidenecyclohexyl]acetamide
CID 89291930
2,2-dimethyl-N-[(1R)-3-methylidenecyclohexyl]propanamide
CID 90161951
N-(3-methylidenecyclohexyl)acetamide
CID 90736034
N-(4-pentylidenecyclohexyl)acetamide
CID 118946881

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamido-4-methylidenecyclohexyl)acetamide?
The IUPAC name of N-(2-acetamido-4-methylidenecyclohexyl)acetamide (CID 91260534) is N-(2-acetamido-4-methylidenecyclohexyl)acetamide.
What is the SMILES notation for N-(2-acetamido-4-methylidenecyclohexyl)acetamide?
The canonical SMILES for N-(2-acetamido-4-methylidenecyclohexyl)acetamide is C=C1CCC(NC(C)=O)C(NC(C)=O)C1.
What is the InChIKey of N-(2-acetamido-4-methylidenecyclohexyl)acetamide?
The InChIKey is OKZHTMJOYQYWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-7-4-5-10(12-8(2)14)11(6-7)13-9(3)15/h10-11H,1,4-6H2,2-3H3,(H,12,14)(H,13,15).
What are the key properties of N-(2-acetamido-4-methylidenecyclohexyl)acetamide?
N-(2-acetamido-4-methylidenecyclohexyl)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamido-4-methylidenecyclohexyl)acetamide is sourced from PubChem (CID 91260534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).