4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine

C11H20N4 — CID 63758557

IUPAC4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine
SMILESCc1nn(C)c(NC2CCCC2)c1CN
InChIInChI=1S/C11H20N4/c1-8-10(7-12)11(15(2)14-8)13-9-5-3-4-6-9/h9,13H,3-7,12H2,1-2H3
InChIKeyYTKHDKCGDKRMBK-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.54
Rot. Bonds3

About 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine

4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine (PubChem CID 63758557) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine
PubChem CID63758557
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine
SMILESCc1nn(C)c(NC2CCCC2)c1CN
InChIInChI=1S/C11H20N4/c1-8-10(7-12)11(15(2)14-8)13-9-5-3-4-6-9/h9,13H,3-7,12H2,1-2H3
InChIKeyYTKHDKCGDKRMBK-UHFFFAOYSA-N
XLogP1.54
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine?
The IUPAC name of 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine (CID 63758557) is 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine.
What is the SMILES notation for 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine?
The canonical SMILES for 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine is Cc1nn(C)c(NC2CCCC2)c1CN.
What is the InChIKey of 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine?
The InChIKey is YTKHDKCGDKRMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-8-10(7-12)11(15(2)14-8)13-9-5-3-4-6-9/h9,13H,3-7,12H2,1-2H3.
What are the key properties of 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine?
4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine has a molecular weight of 208.31 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-cyclopentyl-1,3-dimethylpyrazol-5-amine is sourced from PubChem (CID 63758557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).