4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine

C15H28N4 — CID 55046155

IUPAC4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine
SMILESCCN(Cc1c(C)nn(C)c1NC)C1CCCCC1
InChIInChI=1S/C15H28N4/c1-5-19(13-9-7-6-8-10-13)11-14-12(2)17-18(4)15(14)16-3/h13,16H,5-11H2,1-4H3
InChIKeyVJGQWZNSXZDBQQ-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.92
Rot. Bonds5

About 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine

4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine (PubChem CID 55046155) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine
PubChem CID55046155
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine
SMILESCCN(Cc1c(C)nn(C)c1NC)C1CCCCC1
InChIInChI=1S/C15H28N4/c1-5-19(13-9-7-6-8-10-13)11-14-12(2)17-18(4)15(14)16-3/h13,16H,5-11H2,1-4H3
InChIKeyVJGQWZNSXZDBQQ-UHFFFAOYSA-N
XLogP2.92
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine?
The IUPAC name of 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine (CID 55046155) is 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine.
What is the SMILES notation for 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine?
The canonical SMILES for 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine is CCN(Cc1c(C)nn(C)c1NC)C1CCCCC1.
What is the InChIKey of 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine?
The InChIKey is VJGQWZNSXZDBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-5-19(13-9-7-6-8-10-13)11-14-12(2)17-18(4)15(14)16-3/h13,16H,5-11H2,1-4H3.
What are the key properties of 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine?
4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine has a molecular weight of 264.42 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[cyclohexyl(ethyl)amino]methyl]-N,1,3-trimethylpyrazol-5-amine is sourced from PubChem (CID 55046155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).