2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine

C9H15N3O2 — CID 116794334

IUPAC2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine
SMILESCOC1C(N)CC1Oc1cnn(C)c1
InChIInChI=1S/C9H15N3O2/c1-12-5-6(4-11-12)14-8-3-7(10)9(8)13-2/h4-5,7-9H,3,10H2,1-2H3
InChIKeyCTXLPAQFLPFITE-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.09
Rot. Bonds3

About 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine

2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine (PubChem CID 116794334) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine.

Molecular Properties

Compound Name2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine
PubChem CID116794334
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine
SMILESCOC1C(N)CC1Oc1cnn(C)c1
InChIInChI=1S/C9H15N3O2/c1-12-5-6(4-11-12)14-8-3-7(10)9(8)13-2/h4-5,7-9H,3,10H2,1-2H3
InChIKeyCTXLPAQFLPFITE-UHFFFAOYSA-N
XLogP-0.09
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine 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 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine?
The IUPAC name of 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine (CID 116794334) is 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine.
What is the SMILES notation for 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine?
The canonical SMILES for 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine is COC1C(N)CC1Oc1cnn(C)c1.
What is the InChIKey of 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine?
The InChIKey is CTXLPAQFLPFITE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-12-5-6(4-11-12)14-8-3-7(10)9(8)13-2/h4-5,7-9H,3,10H2,1-2H3.
What are the key properties of 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine?
2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine has a molecular weight of 197.24 g/mol, XLogP of -0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(1-methylpyrazol-4-yl)oxycyclobutan-1-amine is sourced from PubChem (CID 116794334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).