3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol

C11H19N3O — CID 103006526

IUPAC3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
SMILESCn1cc(CCC2(O)CCC(N)C2)cn1
InChIInChI=1S/C11H19N3O/c1-14-8-9(7-13-14)2-4-11(15)5-3-10(12)6-11/h7-8,10,15H,2-6,12H2,1H3
InChIKeyPJIOLNNMYWENSV-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.60
Rot. Bonds3

About 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol

3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol (PubChem CID 103006526) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
PubChem CID103006526
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
SMILESCn1cc(CCC2(O)CCC(N)C2)cn1
InChIInChI=1S/C11H19N3O/c1-14-8-9(7-13-14)2-4-11(15)5-3-10(12)6-11/h7-8,10,15H,2-6,12H2,1H3
InChIKeyPJIOLNNMYWENSV-UHFFFAOYSA-N
XLogP0.60
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol?
The IUPAC name of 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol (CID 103006526) is 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol?
The canonical SMILES for 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol is Cn1cc(CCC2(O)CCC(N)C2)cn1.
What is the InChIKey of 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol?
The InChIKey is PJIOLNNMYWENSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-8-9(7-13-14)2-4-11(15)5-3-10(12)6-11/h7-8,10,15H,2-6,12H2,1H3.
What are the key properties of 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol?
3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 103006526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).