N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine

C14H25N3 — CID 43204437

IUPACN-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
SMILESCc1nn(C)c(C)c1NC1C(C)CCCC1C
InChIInChI=1S/C14H25N3/c1-9-7-6-8-10(2)13(9)15-14-11(3)16-17(5)12(14)4/h9-10,13,15H,6-8H2,1-5H3
InChIKeyIJSVZNGVTNDVAF-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.27
Rot. Bonds2

About N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine

N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine (PubChem CID 43204437) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine.

Molecular Properties

Compound NameN-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
PubChem CID43204437
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
SMILESCc1nn(C)c(C)c1NC1C(C)CCCC1C
InChIInChI=1S/C14H25N3/c1-9-7-6-8-10(2)13(9)15-14-11(3)16-17(5)12(14)4/h9-10,13,15H,6-8H2,1-5H3
InChIKeyIJSVZNGVTNDVAF-UHFFFAOYSA-N
XLogP3.27
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine?
The IUPAC name of N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine (CID 43204437) is N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine.
What is the SMILES notation for N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine?
The canonical SMILES for N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine is Cc1nn(C)c(C)c1NC1C(C)CCCC1C.
What is the InChIKey of N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine?
The InChIKey is IJSVZNGVTNDVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-9-7-6-8-10(2)13(9)15-14-11(3)16-17(5)12(14)4/h9-10,13,15H,6-8H2,1-5H3.
What are the key properties of N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine?
N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine has a molecular weight of 235.37 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine is sourced from PubChem (CID 43204437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).