N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide

C11H21NO2 — CID 175786245

IUPACN-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide
SMILESCCN(C)C(=O)CC1(O)CCCCC1
InChIInChI=1S/C11H21NO2/c1-3-12(2)10(13)9-11(14)7-5-4-6-8-11/h14H,3-9H2,1-2H3
InChIKeyMSPJXDCREPUFOX-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.55
Rot. Bonds3

About N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide

N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide (PubChem CID 175786245) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide
PubChem CID175786245
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide
SMILESCCN(C)C(=O)CC1(O)CCCCC1
InChIInChI=1S/C11H21NO2/c1-3-12(2)10(13)9-11(14)7-5-4-6-8-11/h14H,3-9H2,1-2H3
InChIKeyMSPJXDCREPUFOX-UHFFFAOYSA-N
XLogP1.55
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide?
The IUPAC name of N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide (CID 175786245) is N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide?
The canonical SMILES for N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide is CCN(C)C(=O)CC1(O)CCCCC1.
What is the InChIKey of N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide?
The InChIKey is MSPJXDCREPUFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-12(2)10(13)9-11(14)7-5-4-6-8-11/h14H,3-9H2,1-2H3.
What are the key properties of N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide?
N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide has a molecular weight of 199.29 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-hydroxycyclohexyl)-N-methylacetamide is sourced from PubChem (CID 175786245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).