1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine

C11H16N4OS — CID 121417965

IUPAC1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine
SMILESCC(N)COC(c1cncs1)c1ccnn1C
InChIInChI=1S/C11H16N4OS/c1-8(12)6-16-11(10-5-13-7-17-10)9-3-4-14-15(9)2/h3-5,7-8,11H,6,12H2,1-2H3
InChIKeyUQIVVPWAHXGHHO-UHFFFAOYSA-N
MW252.34 g/mol
LogP1.33
Rot. Bonds5

About 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine

1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine (PubChem CID 121417965) has the molecular formula C11H16N4OS and a molecular weight of 252.34 g/mol. Its IUPAC name is 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine.

Molecular Properties

Compound Name1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine
PubChem CID121417965
Molecular FormulaC11H16N4OS
Molecular Weight252.34 g/mol
Exact Mass252.10
IUPAC Name1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine
SMILESCC(N)COC(c1cncs1)c1ccnn1C
InChIInChI=1S/C11H16N4OS/c1-8(12)6-16-11(10-5-13-7-17-10)9-3-4-14-15(9)2/h3-5,7-8,11H,6,12H2,1-2H3
InChIKeyUQIVVPWAHXGHHO-UHFFFAOYSA-N
XLogP1.33
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-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 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine?
The IUPAC name of 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine (CID 121417965) is 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine.
What is the SMILES notation for 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine?
The canonical SMILES for 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine is CC(N)COC(c1cncs1)c1ccnn1C.
What is the InChIKey of 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine?
The InChIKey is UQIVVPWAHXGHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4OS/c1-8(12)6-16-11(10-5-13-7-17-10)9-3-4-14-15(9)2/h3-5,7-8,11H,6,12H2,1-2H3.
What are the key properties of 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine?
1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine has a molecular weight of 252.34 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylpyrazol-3-yl)-(1,3-thiazol-5-yl)methoxy]propan-2-amine is sourced from PubChem (CID 121417965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).