N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine

C11H19N3 — CID 130607965

IUPACN-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine
SMILESCc1cc(NC(C)C2CCC2)nn1C
InChIInChI=1S/C11H19N3/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-10/h7,9-10H,4-6H2,1-3H3,(H,12,13)
InChIKeyWEYHRXJQNFWCHU-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.33
Rot. Bonds3

About N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine

N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine (PubChem CID 130607965) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine
PubChem CID130607965
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine
SMILESCc1cc(NC(C)C2CCC2)nn1C
InChIInChI=1S/C11H19N3/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-10/h7,9-10H,4-6H2,1-3H3,(H,12,13)
InChIKeyWEYHRXJQNFWCHU-UHFFFAOYSA-N
XLogP2.33
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine?
The IUPAC name of N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine (CID 130607965) is N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine is Cc1cc(NC(C)C2CCC2)nn1C.
What is the InChIKey of N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine?
The InChIKey is WEYHRXJQNFWCHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-10/h7,9-10H,4-6H2,1-3H3,(H,12,13).
What are the key properties of N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine?
N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine has a molecular weight of 193.29 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 130607965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).