4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine

C16H30N4 — CID 63815837

IUPAC4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C2CCCCC2C)c1CC(C)N
InChIInChI=1S/C16H30N4/c1-11-8-6-7-9-15(11)19(4)16-14(10-12(2)17)13(3)18-20(16)5/h11-12,15H,6-10,17H2,1-5H3
InChIKeyMMQLEKNVHNRJCF-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.63
Rot. Bonds4

About 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine

4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine (PubChem CID 63815837) has the molecular formula C16H30N4 and a molecular weight of 278.44 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine
PubChem CID63815837
Molecular FormulaC16H30N4
Molecular Weight278.44 g/mol
Exact Mass278.25
IUPAC Name4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C2CCCCC2C)c1CC(C)N
InChIInChI=1S/C16H30N4/c1-11-8-6-7-9-15(11)19(4)16-14(10-12(2)17)13(3)18-20(16)5/h11-12,15H,6-10,17H2,1-5H3
InChIKeyMMQLEKNVHNRJCF-UHFFFAOYSA-N
XLogP2.63
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,1,3-trimethylpyrazol-5-amine
CID 63815854
1,3-dimethyl-5-[methyl-(2-methylcyclohexyl)amino]pyrazole-4-carbaldehyde
CID 55005227
4-(2-aminopropyl)-N-(4-fluorophenyl)-N,1,3-trimethylpyrazol-5-amine
CID 63815275
4-(2-aminopropyl)-1,3-dimethyl-N-propan-2-yl-N-propylpyrazol-5-amine
CID 63785131
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-aminoethyl)-N,1,3-trimethyl-N-(2-methyloxolan-3-yl)pyrazol-5-amine
CID 82753870
N-cyclohexyl-N,1,3-trimethyl-4-(propylaminomethyl)pyrazol-5-amine
CID 43280836
4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylsulfonylethyl)pyrazol-5-amine
CID 79859068
4-[(tert-butylamino)methyl]-N-cyclopentyl-N,1,3-trimethylpyrazol-5-amine
CID 63061086
1-[5-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1,3-dimethylpyrazol-4-yl]propan-2-amine
CID 115562579
4-(2-aminopropyl)-N-[(4-chlorophenyl)methyl]-N,1,3-trimethylpyrazol-5-amine
CID 63815150

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine?
The IUPAC name of 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine (CID 63815837) is 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine.
What is the SMILES notation for 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine?
The canonical SMILES for 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine is Cc1nn(C)c(N(C)C2CCCCC2C)c1CC(C)N.
What is the InChIKey of 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine?
The InChIKey is MMQLEKNVHNRJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4/c1-11-8-6-7-9-15(11)19(4)16-14(10-12(2)17)13(3)18-20(16)5/h11-12,15H,6-10,17H2,1-5H3.
What are the key properties of 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine?
4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine has a molecular weight of 278.44 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N,1,3-trimethyl-N-(2-methylcyclohexyl)pyrazol-5-amine is sourced from PubChem (CID 63815837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).