4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine

C17H32N4 — CID 63815854

IUPAC4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine
SMILESCCC1CCC(N(C)c2c(CC(C)N)c(C)nn2C)CC1
InChIInChI=1S/C17H32N4/c1-6-14-7-9-15(10-8-14)20(4)17-16(11-12(2)18)13(3)19-21(17)5/h12,14-15H,6-11,18H2,1-5H3
InChIKeyQZINTGGMXQOWRG-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.02
Rot. Bonds5

About 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine

4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine (PubChem CID 63815854) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine
PubChem CID63815854
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC Name4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine
SMILESCCC1CCC(N(C)c2c(CC(C)N)c(C)nn2C)CC1
InChIInChI=1S/C17H32N4/c1-6-14-7-9-15(10-8-14)20(4)17-16(11-12(2)18)13(3)19-21(17)5/h12,14-15H,6-11,18H2,1-5H3
InChIKeyQZINTGGMXQOWRG-UHFFFAOYSA-N
XLogP3.02
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[(4-ethylcyclohexyl)-methylamino]-1,3-dimethylpyrazol-4-yl]methanol
CID 61449265
4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine
CID 63815837
4-(2-aminopropyl)-1,3-dimethyl-N-propan-2-yl-N-propylpyrazol-5-amine
CID 63785131
4-(2-aminopropyl)-N-(4-fluorophenyl)-N,1,3-trimethylpyrazol-5-amine
CID 63815275
1-ethyl-5-N-(4-ethylcyclohexyl)-5-N,3-dimethylpyrazole-4,5-diamine
CID 66013415
1-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
CID 23005892
N,1,3-trimethyl-N-(4-methylcyclohexyl)-4-(propylaminomethyl)pyrazol-5-amine
CID 61437594
4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylsulfonylethyl)pyrazol-5-amine
CID 79859068
4-(2-aminobutyl)-N-cyclopropyl-1,3-dimethyl-N-(2,2,2-trifluoroethyl)pyrazol-5-amine
CID 63795763
4-(2-aminopropyl)-N-[(4-chlorophenyl)methyl]-N,1,3-trimethylpyrazol-5-amine
CID 63815150
4-(2-aminopropyl)-N-(2-methoxyethyl)-1,3-dimethyl-N-propan-2-ylpyrazol-5-amine
CID 82965033
N-cyclohexyl-N,1,3-trimethyl-4-(propylaminomethyl)pyrazol-5-amine
CID 43280836

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine?
The IUPAC name of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine (CID 63815854) is 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine.
What is the SMILES notation for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine?
The canonical SMILES for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine is CCC1CCC(N(C)c2c(CC(C)N)c(C)nn2C)CC1.
What is the InChIKey of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine?
The InChIKey is QZINTGGMXQOWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-6-14-7-9-15(10-8-14)20(4)17-16(11-12(2)18)13(3)19-21(17)5/h12,14-15H,6-11,18H2,1-5H3.
What are the key properties of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine?
4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine has a molecular weight of 292.47 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine is sourced from PubChem (CID 63815854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).