2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide

C18H32N2O4 — CID 123961305

IUPAC2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide
SMILESCOCC(=O)NC1CCC(C2CCC(NC(=O)COC)CC2)CC1
InChIInChI=1S/C18H32N2O4/c1-23-11-17(21)19-15-7-3-13(4-8-15)14-5-9-16(10-6-14)20-18(22)12-24-2/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyLZQVIHJYUGZPGD-UHFFFAOYSA-N
MW340.46 g/mol
LogP1.63
Rot. Bonds7

About 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide

2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide (PubChem CID 123961305) has the molecular formula C18H32N2O4 and a molecular weight of 340.46 g/mol. Its IUPAC name is 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide
PubChem CID123961305
Molecular FormulaC18H32N2O4
Molecular Weight340.46 g/mol
Exact Mass340.24
IUPAC Name2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide
SMILESCOCC(=O)NC1CCC(C2CCC(NC(=O)COC)CC2)CC1
InChIInChI=1S/C18H32N2O4/c1-23-11-17(21)19-15-7-3-13(4-8-15)14-5-9-16(10-6-14)20-18(22)12-24-2/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyLZQVIHJYUGZPGD-UHFFFAOYSA-N
XLogP1.63
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.46
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide?
The IUPAC name of 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide (CID 123961305) is 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide is COCC(=O)NC1CCC(C2CCC(NC(=O)COC)CC2)CC1.
What is the InChIKey of 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide?
The InChIKey is LZQVIHJYUGZPGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O4/c1-23-11-17(21)19-15-7-3-13(4-8-15)14-5-9-16(10-6-14)20-18(22)12-24-2/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide?
2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide has a molecular weight of 340.46 g/mol, XLogP of 1.63, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-[4-[(2-methoxyacetyl)amino]cyclohexyl]cyclohexyl]acetamide is sourced from PubChem (CID 123961305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).