2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen

C13H28N2O2 — CID 177055466

IUPAC2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen
SMILESCCN(CC(=O)NCCOC)C1CCCCC1.[H][H]
InChIInChI=1S/C13H26N2O2.H2/c1-3-15(12-7-5-4-6-8-12)11-13(16)14-9-10-17-2;/h12H,3-11H2,1-2H3,(H,14,16);1H
InChIKeySNDHLEPDQPZBJX-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.65
Rot. Bonds7

About 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen

2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen (PubChem CID 177055466) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen.

Molecular Properties

Compound Name2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen
PubChem CID177055466
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen
SMILESCCN(CC(=O)NCCOC)C1CCCCC1.[H][H]
InChIInChI=1S/C13H26N2O2.H2/c1-3-15(12-7-5-4-6-8-12)11-13(16)14-9-10-17-2;/h12H,3-11H2,1-2H3,(H,14,16);1H
InChIKeySNDHLEPDQPZBJX-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen?
The IUPAC name of 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen (CID 177055466) is 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen.
What is the SMILES notation for 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen?
The canonical SMILES for 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen is CCN(CC(=O)NCCOC)C1CCCCC1.[H][H].
What is the InChIKey of 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen?
The InChIKey is SNDHLEPDQPZBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.H2/c1-3-15(12-7-5-4-6-8-12)11-13(16)14-9-10-17-2;/h12H,3-11H2,1-2H3,(H,14,16);1H.
What are the key properties of 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen?
2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen has a molecular weight of 244.38 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(ethyl)amino]-N-(2-methoxyethyl)acetamide;molecular hydrogen is sourced from PubChem (CID 177055466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).