2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide

C14H23N3O2 — CID 87002544

IUPAC2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)COC1CCCCC1
InChIInChI=1S/C14H23N3O2/c1-16(9-12-8-15-17(2)10-12)14(18)11-19-13-6-4-3-5-7-13/h8,10,13H,3-7,9,11H2,1-2H3
InChIKeyJLAHZYYURBGTKN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.73
Rot. Bonds5

About 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide

2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide (PubChem CID 87002544) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
PubChem CID87002544
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)COC1CCCCC1
InChIInChI=1S/C14H23N3O2/c1-16(9-12-8-15-17(2)10-12)14(18)11-19-13-6-4-3-5-7-13/h8,10,13H,3-7,9,11H2,1-2H3
InChIKeyJLAHZYYURBGTKN-UHFFFAOYSA-N
XLogP1.73
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The IUPAC name of 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide (CID 87002544) is 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide is CN(Cc1cnn(C)c1)C(=O)COC1CCCCC1.
What is the InChIKey of 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The InChIKey is JLAHZYYURBGTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-16(9-12-8-15-17(2)10-12)14(18)11-19-13-6-4-3-5-7-13/h8,10,13H,3-7,9,11H2,1-2H3.
What are the key properties of 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 87002544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).