N-(3-acetamidocyclohexyl)acetamide

C10H18N2O2 — CID 539631

IUPACN-(3-acetamidocyclohexyl)acetamide
SMILESCC(=O)NC1CCCC(NC(C)=O)C1
InChIInChI=1S/C10H18N2O2/c1-7(13)11-9-4-3-5-10(6-9)12-8(2)14/h9-10H,3-6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeySIJKWVBXFDJWOY-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.57
Rot. Bonds2

About N-(3-acetamidocyclohexyl)acetamide

N-(3-acetamidocyclohexyl)acetamide (PubChem CID 539631) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-(3-acetamidocyclohexyl)acetamide.

Molecular Properties

Compound NameN-(3-acetamidocyclohexyl)acetamide
PubChem CID539631
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-(3-acetamidocyclohexyl)acetamide
SMILESCC(=O)NC1CCCC(NC(C)=O)C1
InChIInChI=1S/C10H18N2O2/c1-7(13)11-9-4-3-5-10(6-9)12-8(2)14/h9-10H,3-6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeySIJKWVBXFDJWOY-UHFFFAOYSA-N
XLogP0.57
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidocyclohexyl)acetamide?
The IUPAC name of N-(3-acetamidocyclohexyl)acetamide (CID 539631) is N-(3-acetamidocyclohexyl)acetamide.
What is the SMILES notation for N-(3-acetamidocyclohexyl)acetamide?
The canonical SMILES for N-(3-acetamidocyclohexyl)acetamide is CC(=O)NC1CCCC(NC(C)=O)C1.
What is the InChIKey of N-(3-acetamidocyclohexyl)acetamide?
The InChIKey is SIJKWVBXFDJWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7(13)11-9-4-3-5-10(6-9)12-8(2)14/h9-10H,3-6H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N-(3-acetamidocyclohexyl)acetamide?
N-(3-acetamidocyclohexyl)acetamide has a molecular weight of 198.27 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidocyclohexyl)acetamide is sourced from PubChem (CID 539631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).