1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine

C10H14N4OS — CID 63656819

IUPAC1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine
SMILESCOCCn1cc(NCc2nccs2)cn1
InChIInChI=1S/C10H14N4OS/c1-15-4-3-14-8-9(6-13-14)12-7-10-11-2-5-16-10/h2,5-6,8,12H,3-4,7H2,1H3
InChIKeyFCRWPJQVLISJHV-UHFFFAOYSA-N
MW238.32 g/mol
LogP1.60
Rot. Bonds6

About 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine

1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine (PubChem CID 63656819) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine
PubChem CID63656819
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC Name1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine
SMILESCOCCn1cc(NCc2nccs2)cn1
InChIInChI=1S/C10H14N4OS/c1-15-4-3-14-8-9(6-13-14)12-7-10-11-2-5-16-10/h2,5-6,8,12H,3-4,7H2,1H3
InChIKeyFCRWPJQVLISJHV-UHFFFAOYSA-N
XLogP1.60
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine (CID 63656819) is 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine is COCCn1cc(NCc2nccs2)cn1.
What is the InChIKey of 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine?
The InChIKey is FCRWPJQVLISJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-15-4-3-14-8-9(6-13-14)12-7-10-11-2-5-16-10/h2,5-6,8,12H,3-4,7H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine?
1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine has a molecular weight of 238.32 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(1,3-thiazol-2-ylmethyl)pyrazol-4-amine is sourced from PubChem (CID 63656819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).