1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine

C10H17N3O — CID 43662506

IUPAC1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine
SMILESCC(NCc1ccn[nH]1)C1CCCO1
InChIInChI=1S/C10H17N3O/c1-8(10-3-2-6-14-10)11-7-9-4-5-12-13-9/h4-5,8,10-11H,2-3,6-7H2,1H3,(H,12,13)
InChIKeyMABHCECOAHAZTK-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.07
Rot. Bonds4

About 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine

1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine (PubChem CID 43662506) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine
PubChem CID43662506
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine
SMILESCC(NCc1ccn[nH]1)C1CCCO1
InChIInChI=1S/C10H17N3O/c1-8(10-3-2-6-14-10)11-7-9-4-5-12-13-9/h4-5,8,10-11H,2-3,6-7H2,1H3,(H,12,13)
InChIKeyMABHCECOAHAZTK-UHFFFAOYSA-N
XLogP1.07
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine 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 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine?
The IUPAC name of 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine (CID 43662506) is 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine.
What is the SMILES notation for 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine?
The canonical SMILES for 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine is CC(NCc1ccn[nH]1)C1CCCO1.
What is the InChIKey of 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine?
The InChIKey is MABHCECOAHAZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8(10-3-2-6-14-10)11-7-9-4-5-12-13-9/h4-5,8,10-11H,2-3,6-7H2,1H3,(H,12,13).
What are the key properties of 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine?
1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine has a molecular weight of 195.27 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-N-(1H-pyrazol-5-ylmethyl)ethanamine is sourced from PubChem (CID 43662506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).