5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine

C15H27N3O — CID 114340426

IUPAC5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine
SMILESCCCn1nc(C)c(N)c1OC1CCC(C)(C)CC1
InChIInChI=1S/C15H27N3O/c1-5-10-18-14(13(16)11(2)17-18)19-12-6-8-15(3,4)9-7-12/h12H,5-10,16H2,1-4H3
InChIKeyKZYBLBKCRSVLHS-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.53
Rot. Bonds4

About 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine

5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine (PubChem CID 114340426) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine.

Molecular Properties

Compound Name5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine
PubChem CID114340426
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine
SMILESCCCn1nc(C)c(N)c1OC1CCC(C)(C)CC1
InChIInChI=1S/C15H27N3O/c1-5-10-18-14(13(16)11(2)17-18)19-12-6-8-15(3,4)9-7-12/h12H,5-10,16H2,1-4H3
InChIKeyKZYBLBKCRSVLHS-UHFFFAOYSA-N
XLogP3.53
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-cyclopentyloxy-3-methyl-1-propylpyrazol-4-amine
CID 66029227
5-cyclobutyloxy-1,3-dimethylpyrazol-4-amine
CID 62116290
1,3-dimethyl-5-(4-methylcyclohexyl)oxypyrazol-4-amine
CID 43554434
5-cyclopentyloxy-1,3-dimethylpyrazol-4-amine
CID 43554361
3-methyl-5-N-(1-methylcyclopentyl)-1-propylpyrazole-4,5-diamine
CID 66029174
3-methyl-5-(2-piperidin-1-ylethoxy)-1-propylpyrazol-4-amine
CID 66029042
3-methyl-5-N-(4-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66027024
3,5-dimethyl-1-propylpyrazol-4-amine;hydrochloride
CID 50944289
5-N-cyclohexyl-5-N-ethyl-3-methyl-1-propylpyrazole-4,5-diamine
CID 66013691
5-(3,5-dichlorophenoxy)-3-methyl-1-propylpyrazol-4-amine
CID 66028268
3-methyl-5-(2-methylphenoxy)-1-propylpyrazol-4-amine
CID 66028263
5-(3-fluorophenoxy)-3-methyl-1-propylpyrazol-4-amine
CID 66028842

Frequently Asked Questions

What is the IUPAC name of 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine?
The IUPAC name of 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine (CID 114340426) is 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine.
What is the SMILES notation for 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine?
The canonical SMILES for 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine is CCCn1nc(C)c(N)c1OC1CCC(C)(C)CC1.
What is the InChIKey of 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine?
The InChIKey is KZYBLBKCRSVLHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-5-10-18-14(13(16)11(2)17-18)19-12-6-8-15(3,4)9-7-12/h12H,5-10,16H2,1-4H3.
What are the key properties of 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine?
5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine has a molecular weight of 265.40 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,4-dimethylcyclohexyl)oxy-3-methyl-1-propylpyrazol-4-amine is sourced from PubChem (CID 114340426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).