2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide

C15H28N2O2 — CID 65240683

IUPAC2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide
SMILESCNC1(CC(=O)NC(C)C2CCCO2)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-12(13-7-6-10-19-13)17-14(18)11-15(16-2)8-4-3-5-9-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyDBWFIFJQPDKLGD-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.98
Rot. Bonds5

About 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide

2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide (PubChem CID 65240683) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide
PubChem CID65240683
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide
SMILESCNC1(CC(=O)NC(C)C2CCCO2)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-12(13-7-6-10-19-13)17-14(18)11-15(16-2)8-4-3-5-9-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyDBWFIFJQPDKLGD-UHFFFAOYSA-N
XLogP1.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide?
The IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide (CID 65240683) is 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide?
The canonical SMILES for 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide is CNC1(CC(=O)NC(C)C2CCCO2)CCCCC1.
What is the InChIKey of 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide?
The InChIKey is DBWFIFJQPDKLGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(13-7-6-10-19-13)17-14(18)11-15(16-2)8-4-3-5-9-15/h12-13,16H,3-11H2,1-2H3,(H,17,18).
What are the key properties of 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide?
2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide has a molecular weight of 268.40 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)cyclohexyl]-N-[1-(oxolan-2-yl)ethyl]acetamide is sourced from PubChem (CID 65240683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).