3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride

C9H16ClN3O — CID 102565578

IUPAC3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride
SMILESCl.Cn1cc(N)c(OC2CCCC2)n1
InChIInChI=1S/C9H15N3O.ClH/c1-12-6-8(10)9(11-12)13-7-4-2-3-5-7;/h6-7H,2-5,10H2,1H3;1H
InChIKeyRWRDBDQLTUKSLP-UHFFFAOYSA-N
MW217.70 g/mol
LogP1.75
Rot. Bonds2

About 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride

3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride (PubChem CID 102565578) has the molecular formula C9H16ClN3O and a molecular weight of 217.70 g/mol. Its IUPAC name is 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride.

Molecular Properties

Compound Name3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride
PubChem CID102565578
Molecular FormulaC9H16ClN3O
Molecular Weight217.70 g/mol
Exact Mass217.10
IUPAC Name3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride
SMILESCl.Cn1cc(N)c(OC2CCCC2)n1
InChIInChI=1S/C9H15N3O.ClH/c1-12-6-8(10)9(11-12)13-7-4-2-3-5-7;/h6-7H,2-5,10H2,1H3;1H
InChIKeyRWRDBDQLTUKSLP-UHFFFAOYSA-N
XLogP1.75
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.70
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride?
The IUPAC name of 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride (CID 102565578) is 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride.
What is the SMILES notation for 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride?
The canonical SMILES for 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride is Cl.Cn1cc(N)c(OC2CCCC2)n1.
What is the InChIKey of 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride?
The InChIKey is RWRDBDQLTUKSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O.ClH/c1-12-6-8(10)9(11-12)13-7-4-2-3-5-7;/h6-7H,2-5,10H2,1H3;1H.
What are the key properties of 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride?
3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride has a molecular weight of 217.70 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyloxy-1-methylpyrazol-4-amine;hydrochloride is sourced from PubChem (CID 102565578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).