N-(4-aminocyclohexyl)-2-methoxyacetamide

C9H18N2O2 — CID 61279804

IUPACN-(4-aminocyclohexyl)-2-methoxyacetamide
SMILESCOCC(=O)NC1CCC(N)CC1
InChIInChI=1S/C9H18N2O2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeySCLWTHCFOIFAIL-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.02
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-methoxyacetamide

N-(4-aminocyclohexyl)-2-methoxyacetamide (PubChem CID 61279804) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-methoxyacetamide
PubChem CID61279804
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(4-aminocyclohexyl)-2-methoxyacetamide
SMILESCOCC(=O)NC1CCC(N)CC1
InChIInChI=1S/C9H18N2O2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeySCLWTHCFOIFAIL-UHFFFAOYSA-N
XLogP0.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-methoxyacetamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-methoxyacetamide (CID 61279804) is N-(4-aminocyclohexyl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-methoxyacetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-methoxyacetamide is COCC(=O)NC1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-methoxyacetamide?
The InChIKey is SCLWTHCFOIFAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h7-8H,2-6,10H2,1H3,(H,11,12).
What are the key properties of N-(4-aminocyclohexyl)-2-methoxyacetamide?
N-(4-aminocyclohexyl)-2-methoxyacetamide has a molecular weight of 186.25 g/mol, XLogP of 0.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-methoxyacetamide is sourced from PubChem (CID 61279804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).